10411334
  -OEChem-05082423342D

 46 45  0     0  0  0  0  0  0999 V2000
   10.1885    3.6932    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.4564    3.6932    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.9205    4.6932    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.5545    5.0592    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   11.5545    3.3272    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.7244    4.6932    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.0904    3.3272    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.0904    5.0592    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.6885    4.5592    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6885    2.8272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9564    2.8272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9564    4.5592    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1350    5.0369    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6350    6.5758    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    9.3225    3.1932    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    2.2690    3.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2690    2.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1350    4.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    2.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    1.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9440    5.6247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3260    5.6247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5369    0.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6350    6.5758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2228    7.3848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0545    4.1932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5904    4.1932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0569    4.1195    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6584    3.4293    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4810    1.9543    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8796    2.6446    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3471    3.4543    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7456    4.1446    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1909    2.6195    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7924    1.9293    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6150    0.4543    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0135    1.1446    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5337    5.4331    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7363    5.4331    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2269    1.0739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8469    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2706    7.0774    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7244    7.0204    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5872    7.8864    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7212    7.7492    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  2  0  0  0  0
  1 10  2  0  0  0  0
  1 15  1  0  0  0  0
  1 26  1  0  0  0  0
  2 11  2  0  0  0  0
  2 12  2  0  0  0  0
  2 15  1  0  0  0  0
  2 27  1  0  0  0  0
  3 26  1  0  0  0  0
  4 26  1  0  0  0  0
  5 26  1  0  0  0  0
  6 27  1  0  0  0  0
  7 27  1  0  0  0  0
  8 27  1  0  0  0  0
 13 18  1  0  0  0  0
 13 21  1  0  0  0  0
 13 22  1  0  0  0  0
 14 21  2  0  0  0  0
 14 24  1  0  0  0  0
 14 25  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 28  1  0  0  0  0
 16 29  1  0  0  0  0
 17 19  1  0  0  0  0
 17 30  1  0  0  0  0
 17 31  1  0  0  0  0
 18 32  1  0  0  0  0
 18 33  1  0  0  0  0
 19 20  1  0  0  0  0
 19 34  1  0  0  0  0
 19 35  1  0  0  0  0
 20 23  1  0  0  0  0
 20 36  1  0  0  0  0
 20 37  1  0  0  0  0
 21 38  1  0  0  0  0
 22 24  2  0  0  0  0
 22 39  1  0  0  0  0
 23 40  1  0  0  0  0
 23 41  1  0  0  0  0
 23 42  1  0  0  0  0
 24 43  1  0  0  0  0
 25 44  1  0  0  0  0
 25 45  1  0  0  0  0
 25 46  1  0  0  0  0
M  CHG  2  14   1  15  -1
M  END
> <PUBCHEM_COMPOUND_CID>
10411334

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
488

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
11

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
7

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBzOcBgAAAAAAAAAAAAAAAAAWAAAAAAAAAAAAAAAAABgAAAHQQAQAAACADBAhQvkBcMEAKgABAnZHAAgC0REqAJQAAYMACASAIAiAAUAAAIAAKAACEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
bis(trifluoromethylsulfonyl)azanide;1-hexyl-3-methyl-imidazol-3-ium

> <PUBCHEM_IUPAC_CAS_NAME>
bis(trifluoromethylsulfonyl)azanide;1-hexyl-3-methylimidazol-3-ium

> <PUBCHEM_IUPAC_NAME_MARKUP>
bis(trifluoromethylsulfonyl)azanide;1-hexyl-3-methylimidazol-3-ium

> <PUBCHEM_IUPAC_NAME>
bis(trifluoromethylsulfonyl)azanide;1-hexyl-3-methylimidazol-3-ium

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
bis(trifluoromethylsulfonyl)azanide;1-hexyl-3-methyl-imidazol-3-ium

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
ditriflylazanide;1-hexyl-3-methyl-imidazol-3-ium

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C10H19N2.C2F6NO4S2/c1-3-4-5-6-7-12-9-8-11(2)10-12;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h8-10H,3-7H2,1-2H3;/q+1;-1

> <PUBCHEM_IUPAC_INCHIKEY>
RCNFOZUBFOFJKZ-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
447.07211742

> <PUBCHEM_MOLECULAR_FORMULA>
C12H19F6N3O4S2

> <PUBCHEM_MOLECULAR_WEIGHT>
447.4

> <PUBCHEM_OPENEYE_CAN_SMILES>
CCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

> <PUBCHEM_OPENEYE_ISO_SMILES>
CCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

> <PUBCHEM_CACTVS_TPSA>
94.8

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
447.07211742

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
27

> <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>
2

> <PUBCHEM_CACTVS_TAUTO_COUNT>
1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
13  21  8
13  22  8
14  21  8
14  24  8
22  24  8

$$$$