[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2,4-bis(chloranyl)-5-sulfamoyl-benzoate

Systemtic Name: [2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2,4-bis(chloranyl)-5-sulfamoyl-benzoate Openeye Name: [2-(4-nitroanilino)-2-oxo-ethyl] 2,4-dichloro-5-sulfamoyl-benzoate CAS Name: 2,4-dichloro-5-sulfamoylbenzoic acid [2-(4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-nitroanilino)-2-oxoethyl] 2,4-dichloro-5-sulfamoylbenzoate Traditional Name: 2,4-dichloro-5-sulfamoyl-benzoic acid [2-keto-2-(4-nitroanilino)ethyl] ester Formula: C15H11Cl2N3O7S MolecularWeight: 448.23474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)COC(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)COC(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H11Cl2N3O7S/c16-11-6-12(17)13(28(18,25)26)5-10(11)15(22)27-7-14(21)19-8-1-3-9(4-2-8)20(23)24/h1-6H,7H2,(H,19,21)(H2,18,25,26)