3-ethyl-1-methyl-1-octyl-6-(trifluoromethylsulfonyl)benzimidazole-1,3-diium

Systemtic Name: 3-ethyl-1-methyl-1-octyl-6-(trifluoromethylsulfonyl)benzimidazole-1,3-diium Openeye Name: 3-ethyl-1-methyl-1-octyl-6-(trifluoromethylsulfonyl)benzimidazole-1,3-diium CAS Name: 3-ethyl-1-methyl-1-octyl-6-(trifluoromethylsulfonyl)benzimidazole-1,3-diium IUPAC Name: 3-ethyl-1-methyl-1-octyl-6-(trifluoromethylsulfonyl)benzimidazole-1,3-diium Traditional Name: 3-ethyl-1-methyl-1-octyl-6-triflyl-benzimidazole-1,3-diium Formula: C19H29F3N2O2S+2 MolecularWeight: 406.50597

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1(C=[N+](C2=C1C=C(C=C2)S(=O)(=O)C(F)(F)F)CC)C

Isomeric SMILES

CCCCCCCC[N+]1(C=[N+](C2=C1C=C(C=C2)S(=O)(=O)C(F)(F)F)CC)C

InChI

InChI=1S/C19H29F3N2O2S/c1-4-6-7-8-9-10-13-24(3)15-23(5-2)17-12-11-16(14-18(17)24)27(25,26)19(20,21)22/h11-12,14-15H,4-10,13H2,1-3H3/q+2