4-methyl-N-[2-[[(4-methylpyridin-1-ium-2-yl)amino]methyl]phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-[[(4-methylpyridin-1-ium-2-yl)amino]methyl]phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[2-[[(4-methylpyridin-1-ium-2-yl)amino]methyl]phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[2-[[(4-methyl-2-pyridin-1-iumyl)amino]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[2-[[(4-methylpyridin-1-ium-2-yl)amino]methyl]phenyl]benzenesulfonamide Traditional Name: 4-methyl-N-[2-[[(4-methylpyridin-1-ium-2-yl)amino]methyl]phenyl]benzenesulfonamide Formula: C20H22N3O2S+ MolecularWeight: 368.47258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2CNC3=[NH+]C=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2CNC3=[NH+]C=CC(=C3)C

InChI

InChI=1S/C20H21N3O2S/c1-15-7-9-18(10-8-15)26(24,25)23-19-6-4-3-5-17(19)14-22-20-13-16(2)11-12-21-20/h3-13,23H,14H2,1-2H3,(H,21,22)/p+1