N-[3-(3H-benzimidazol-1-ium-1-yl)-2-oxidanyl-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-(3H-benzimidazol-1-ium-1-yl)-2-oxidanyl-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide Openeye Name: N-[3-(3H-benzimidazol-1-ium-1-yl)-2-hydroxy-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide CAS Name: N-[3-(3H-benzimidazol-1-ium-1-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide IUPAC Name: N-[3-(3H-benzimidazol-1-ium-1-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide Traditional Name: N-[3-(3H-benzimidazol-1-ium-1-yl)-2-hydroxy-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide Formula: C24H26N3O4S+ MolecularWeight: 452.54594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C[N+]2=CNC3=CC=CC=C32)O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C[N+]2=CNC3=CC=CC=C32)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H25N3O4S/c1-18-7-13-22(14-8-18)32(29,30)27(19-9-11-21(31-2)12-10-19)16-20(28)15-26-17-25-23-5-3-4-6-24(23)26/h3-14,17,20,28H,15-16H2,1-2H3/p+1