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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CC(=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=CC(=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/c1-15-13-16(11-12-26(15)28)22(27)20-14-18(24)7-10-21(20)25-31(29,30)19-8-5-17(6-9-19)23(2,3)4/h5-14,25H,1-4H3