[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-[(3-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: [1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 2-chloro-5-(m-tolylsulfamoyl)benzoate CAS Name: 2-chloro-5-[(3-methylphenyl)sulfamoyl]benzoic acid [1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-nitroanilino)-1-oxopropan-2-yl] 2-chloro-5-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-(m-tolylsulfamoyl)benzoic acid [2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C23H20ClN3O7S MolecularWeight: 517.9388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC(C)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC(C)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20ClN3O7S/c1-14-5-3-7-17(11-14)26-35(32,33)19-9-10-21(24)20(13-19)23(29)34-15(2)22(28)25-16-6-4-8-18(12-16)27(30)31/h3-13,15,26H,1-2H3,(H,25,28)