2-methyl-N-(3-methylphenyl)-5-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzenesulfonamide

Systemtic Name: 2-methyl-N-(3-methylphenyl)-5-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzenesulfonamide Openeye Name: 5-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-2-methyl-N-(m-tolyl)benzenesulfonamide CAS Name: 5-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-2-methyl-N-(3-methylphenyl)benzenesulfonamide IUPAC Name: 5-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-2-methyl-N-(3-methylphenyl)benzenesulfonamide Traditional Name: 5-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-2-methyl-N-(m-tolyl)benzenesulfonamide Formula: C20H19N3O7S2 MolecularWeight: 477.51076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O7S2/c1-13-4-3-5-15(10-13)22-32(29,30)20-11-16(7-6-14(20)2)21-31(27,28)17-8-9-19(24)18(12-17)23(25)26/h3-12,21-22,24H,1-2H3