N-[4-chloranyl-2-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)carbonyl-phenyl]-4-ethanoyl-benzenesulfonamide

Systemtic Name: N-[4-chloranyl-2-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)carbonyl-phenyl]-4-ethanoyl-benzenesulfonamide Openeye Name: 4-acetyl-N-[4-chloro-2-(6-methyl-1-oxido-pyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide CAS Name: 4-acetyl-N-[4-chloro-2-[(6-methyl-1-oxido-3-pyridin-1-iumyl)-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[4-chloro-2-(6-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[4-chloro-2-(6-methyl-1-oxido-pyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide Formula: C21H17ClN2O5S MolecularWeight: 444.88808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN2O5S/c1-13-3-4-16(12-24(13)27)21(26)19-11-17(22)7-10-20(19)23-30(28,29)18-8-5-15(6-9-18)14(2)25/h3-12,23H,1-2H3