11258643
  -OEChem-04252404142D

 40 39  0     0  0  0  0  0  0999 V2000
    3.4641    0.8660    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.7320    0.8660    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.1962    1.8660    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.8301    2.2320    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8301    0.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.8660    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.3660    0.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.3660    2.2320    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.9641    1.7320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9641    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2320    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2320    1.7320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9379    7.7690    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4379    9.3078    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5981    0.3660    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    2.9379    6.7690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0719    6.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0719    5.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7469    8.3568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1289    8.3568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4379    9.3078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2058    4.7690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0257   10.1168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3301    1.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660    1.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1499    6.1864    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5485    6.8766    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8598    6.8516    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4613    6.1613    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2839    4.6864    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6824    5.3766    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3366    8.1652    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5392    8.1652    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0734    9.8094    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8958    5.3059    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6689    4.4590    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5158    4.2320    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5273    9.7524    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3901   10.6184    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5241   10.4813    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 24  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 25  1  0  0  0  0
  3 24  1  0  0  0  0
  4 24  1  0  0  0  0
  5 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7 25  1  0  0  0  0
  8 25  1  0  0  0  0
 13 16  1  0  0  0  0
 13 19  1  0  0  0  0
 13 20  1  0  0  0  0
 14 19  2  0  0  0  0
 14 21  1  0  0  0  0
 14 23  1  0  0  0  0
 16 17  1  0  0  0  0
 16 26  1  0  0  0  0
 16 27  1  0  0  0  0
 17 18  1  0  0  0  0
 17 28  1  0  0  0  0
 17 29  1  0  0  0  0
 18 22  1  0  0  0  0
 18 30  1  0  0  0  0
 18 31  1  0  0  0  0
 19 32  1  0  0  0  0
 20 21  2  0  0  0  0
 20 33  1  0  0  0  0
 21 34  1  0  0  0  0
 22 35  1  0  0  0  0
 22 36  1  0  0  0  0
 22 37  1  0  0  0  0
 23 38  1  0  0  0  0
 23 39  1  0  0  0  0
 23 40  1  0  0  0  0
M  CHG  2  14   1  15  -1
M  END
> <PUBCHEM_COMPOUND_CID>
11258643

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
467

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
11

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
5

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBzOcBgAAAAAAAAAAAAAAAAAWAAAAAAAAAAAAAAAAABgAAAHQQAQAAACADBAhQvkBcMEAKgABAnZHAAgC0REqAJQAAYMACASAAAiAAUAAAIAAKAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

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

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

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

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

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

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

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C8H15N2.C2F6NO4S2/c1-3-4-5-10-7-6-9(2)8-10;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h6-8H,3-5H2,1-2H3;/q+1;-1

> <PUBCHEM_IUPAC_INCHIKEY>
INDFXCHYORWHLQ-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
419.04081729

> <PUBCHEM_MOLECULAR_FORMULA>
C10H15F6N3O4S2

> <PUBCHEM_MOLECULAR_WEIGHT>
419.4

> <PUBCHEM_OPENEYE_CAN_SMILES>
CCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

> <PUBCHEM_OPENEYE_ISO_SMILES>
CCCCN1C=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>
419.04081729

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
25

> <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  19  8
13  20  8
14  19  8
14  21  8
20  21  8

$$$$