N-[4,5-dimethyl-2-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-phenyl]benzenesulfonamide

Systemtic Name: N-[4,5-dimethyl-2-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-phenyl]benzenesulfonamide Openeye Name: N-[4,5-dimethyl-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]benzenesulfonamide CAS Name: N-[4,5-dimethyl-2-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: N-[4,5-dimethyl-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]benzenesulfonamide Traditional Name: N-[4,5-dimethyl-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]benzenesulfonamide Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C(=O)C2=CC=[N+](C=C2)[O-])NS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C(=C1)C(=O)C2=CC=[N+](C=C2)[O-])NS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H18N2O4S/c1-14-12-18(20(23)16-8-10-22(24)11-9-16)19(13-15(14)2)21-27(25,26)17-6-4-3-5-7-17/h3-13,21H,1-2H3