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

Systemtic Name: 4-tert-butyl-N-[4-chloranyl-2-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)carbonyl-phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-chloro-2-(6-methyl-1-oxido-pyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-chloro-2-[(6-methyl-1-oxido-3-pyridin-1-iumyl)-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-chloro-2-(6-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-chloro-2-(6-methyl-1-oxido-pyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide Formula: C23H23ClN2O4S MolecularWeight: 458.95772

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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(C)(C)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(C)(C)C)[O-]

InChI

InChI=1S/C23H23ClN2O4S/c1-15-5-6-16(14-26(15)28)22(27)20-13-18(24)9-12-21(20)25-31(29,30)19-10-7-17(8-11-19)23(2,3)4/h5-14,25H,1-4H3