11564141
  -OEChem-04232404112D

 81 80  0     0  0  0  0  0  0999 V2000
    3.4641    7.9252    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.7320    7.9252    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.6188    0.8660    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.8868    0.8660    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.1962    8.9252    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.8301    9.2912    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8301    7.5591    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.9252    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.3660    7.5591    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.3660    9.2912    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   14.3509    1.8660    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.9849    2.2320    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   13.9849    0.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.1547    1.8660    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.5208    0.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.5208    2.2320    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.9641    8.7912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9641    7.0591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2320    7.0591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2320    8.7912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1188    1.7320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1188    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3868    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3868    1.7320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7201   13.5009    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.3900    6.0009    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.2201   15.0397    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    8.8073    5.6645    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5981    7.4252    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
   11.7528    0.3660    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
   12.9880    9.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9880   10.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1220    9.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8541   11.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1220    8.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8541   12.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2560    7.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7201   12.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2560    6.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5291   14.0887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4764    6.4076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9111   14.0887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2854    5.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2201   15.0397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3073    4.7984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8079   15.8487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8128    5.7690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3301    8.4252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660    8.4252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4849    1.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0208    1.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2001    8.9183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5986    9.6085    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7760   11.0835    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3774   10.3932    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9100    9.5835    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5114    8.8932    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.0661   10.4183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4646   11.1085    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3341    7.4183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7326    8.1085    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6420   12.5835    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2435   11.8932    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0439    8.0835    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6454    7.3932    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9321   11.9183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3307   12.6085    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4680    5.9183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8666    6.6085    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1188   13.8971    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3475    7.0141    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3214   13.8971    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7462    4.5915    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8557   15.5413    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0551    4.2320    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.3095   15.4843    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1723   16.3503    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3063   16.2132    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8776    6.3856    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    5.8338    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7480    5.1524    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 17  2  0  0  0  0
  1 18  2  0  0  0  0
  1 29  1  0  0  0  0
  1 48  1  0  0  0  0
  2 19  2  0  0  0  0
  2 20  2  0  0  0  0
  2 29  1  0  0  0  0
  2 49  1  0  0  0  0
  3 21  2  0  0  0  0
  3 22  2  0  0  0  0
  3 30  1  0  0  0  0
  3 50  1  0  0  0  0
  4 23  2  0  0  0  0
  4 24  2  0  0  0  0
  4 30  1  0  0  0  0
  4 51  1  0  0  0  0
  5 48  1  0  0  0  0
  6 48  1  0  0  0  0
  7 48  1  0  0  0  0
  8 49  1  0  0  0  0
  9 49  1  0  0  0  0
 10 49  1  0  0  0  0
 11 50  1  0  0  0  0
 12 50  1  0  0  0  0
 13 50  1  0  0  0  0
 14 51  1  0  0  0  0
 15 51  1  0  0  0  0
 16 51  1  0  0  0  0
 25 38  1  0  0  0  0
 25 40  1  0  0  0  0
 25 42  1  0  0  0  0
 26 39  1  0  0  0  0
 26 41  1  0  0  0  0
 26 43  1  0  0  0  0
 27 40  2  0  0  0  0
 27 44  1  0  0  0  0
 27 46  1  0  0  0  0
 28 41  2  0  0  0  0
 28 45  1  0  0  0  0
 28 47  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 31 52  1  0  0  0  0
 31 53  1  0  0  0  0
 32 34  1  0  0  0  0
 32 54  1  0  0  0  0
 32 55  1  0  0  0  0
 33 35  1  0  0  0  0
 33 56  1  0  0  0  0
 33 57  1  0  0  0  0
 34 36  1  0  0  0  0
 34 58  1  0  0  0  0
 34 59  1  0  0  0  0
 35 37  1  0  0  0  0
 35 60  1  0  0  0  0
 35 61  1  0  0  0  0
 36 38  1  0  0  0  0
 36 62  1  0  0  0  0
 36 63  1  0  0  0  0
 37 39  1  0  0  0  0
 37 64  1  0  0  0  0
 37 65  1  0  0  0  0
 38 66  1  0  0  0  0
 38 67  1  0  0  0  0
 39 68  1  0  0  0  0
 39 69  1  0  0  0  0
 40 70  1  0  0  0  0
 41 71  1  0  0  0  0
 42 44  2  0  0  0  0
 42 72  1  0  0  0  0
 43 45  2  0  0  0  0
 43 73  1  0  0  0  0
 44 74  1  0  0  0  0
 45 75  1  0  0  0  0
 46 76  1  0  0  0  0
 46 77  1  0  0  0  0
 46 78  1  0  0  0  0
 47 79  1  0  0  0  0
 47 80  1  0  0  0  0
 47 81  1  0  0  0  0
M  CHG  4  27   1  28   1  29  -1  30  -1
M  END
> <PUBCHEM_COMPOUND_CID>
11564141

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
619

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
22

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
14

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceB7vcBwAAAAAAAAAAAAAAAAAWLAAAAAAAAAAAAAAAAB4AAAHQQAQAAACADBAhQvkBcMEAKgABAnZHAAgC0REqAJQAAYMACASAIAiAAUAAAIAAKAACEQgIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
bis(trifluoromethylsulfonyl)azanide;1-methyl-3-[9-(3-methylimidazol-3-ium-1-yl)nonyl]imidazol-1-ium

> <PUBCHEM_IUPAC_CAS_NAME>
bis(trifluoromethylsulfonyl)azanide;1-methyl-3-[9-(3-methyl-1-imidazol-3-iumyl)nonyl]imidazol-1-ium

> <PUBCHEM_IUPAC_NAME_MARKUP>
bis(trifluoromethylsulfonyl)azanide;1-methyl-3-[9-(3-methylimidazol-3-ium-1-yl)nonyl]imidazol-1-ium

> <PUBCHEM_IUPAC_NAME>
bis(trifluoromethylsulfonyl)azanide;1-methyl-3-[9-(3-methylimidazol-3-ium-1-yl)nonyl]imidazol-1-ium

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
bis(trifluoromethylsulfonyl)azanide;1-methyl-3-[9-(3-methylimidazol-3-ium-1-yl)nonyl]imidazol-1-ium

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
ditriflylazanide;1-methyl-3-[9-(3-methylimidazol-3-ium-1-yl)nonyl]imidazol-1-ium

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C17H30N4.2C2F6NO4S2/c1-18-12-14-20(16-18)10-8-6-4-3-5-7-9-11-21-15-13-19(2)17-21;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h12-17H,3-11H2,1-2H3;;/q+2;2*-1

> <PUBCHEM_IUPAC_INCHIKEY>
GKEXOMDLMYFOMK-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
850.0816346

> <PUBCHEM_MOLECULAR_FORMULA>
C21H30F12N6O8S4

> <PUBCHEM_MOLECULAR_WEIGHT>
850.7

> <PUBCHEM_OPENEYE_CAN_SMILES>
C[N+]1=CN(C=C1)CCCCCCCCCN2C=C[N+](=C2)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

> <PUBCHEM_OPENEYE_ISO_SMILES>
C[N+]1=CN(C=C1)CCCCCCCCCN2C=C[N+](=C2)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

> <PUBCHEM_CACTVS_TPSA>
190

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
850.0816346

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
51

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
3

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
25  40  8
25  42  8
26  41  8
26  43  8
27  40  8
27  44  8
28  41  8
28  45  8
42  44  8
43  45  8

$$$$