1,3-diethyl-2-methyl-N-phenyl-benzimidazol-1-ium-5-sulfonamide

Systemtic Name: 1,3-diethyl-2-methyl-N-phenyl-benzimidazol-1-ium-5-sulfonamide Openeye Name: 1,3-diethyl-2-methyl-N-phenyl-benzimidazol-1-ium-5-sulfonamide CAS Name: 1,3-diethyl-2-methyl-N-phenyl-5-benzimidazol-1-iumsulfonamide IUPAC Name: 1,3-diethyl-2-methyl-N-phenylbenzimidazol-1-ium-5-sulfonamide Traditional Name: 1,3-diethyl-2-methyl-N-phenyl-benzimidazol-1-ium-5-sulfonamide Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=C1C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)CC)C

Isomeric SMILES

CCN1C(=[N+](C2=C1C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)CC)C

InChI

InChI=1S/C18H22N3O2S/c1-4-20-14(3)21(5-2)18-13-16(11-12-17(18)20)24(22,23)19-15-9-7-6-8-10-15/h6-13,19H,4-5H2,1-3H3/q+1