N-(2,3-dimethyl-4-oxidanyl-5-pyridin-1-ium-1-yl-phenyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-(2,3-dimethyl-4-oxidanyl-5-pyridin-1-ium-1-yl-phenyl)-4-methyl-benzenesulfonamide Openeye Name: N-(4-hydroxy-2,3-dimethyl-5-pyridin-1-ium-1-yl-phenyl)-4-methyl-benzenesulfonamide CAS Name: N-[4-hydroxy-2,3-dimethyl-5-(1-pyridin-1-iumyl)phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-(4-hydroxy-2,3-dimethyl-5-pyridin-1-ium-1-ylphenyl)-4-methylbenzenesulfonamide Traditional Name: N-(4-hydroxy-2,3-dimethyl-5-pyridin-1-ium-1-yl-phenyl)-4-methyl-benzenesulfonamide Formula: C20H21N2O3S+ MolecularWeight: 369.45734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=C(C(=C2)[N+]3=CC=CC=C3)O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=C(C(=C2)[N+]3=CC=CC=C3)O)C)C

InChI

InChI=1S/C20H20N2O3S/c1-14-7-9-17(10-8-14)26(24,25)21-18-13-19(20(23)16(3)15(18)2)22-11-5-4-6-12-22/h4-13,21H,1-3H3/p+1