[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 4-sulfamoylbenzoate

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 4-sulfamoylbenzoate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl] 4-sulfamoylbenzoate CAS Name: 4-sulfamoylbenzoic acid [2-(4-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl] 4-sulfamoylbenzoate Traditional Name: 4-sulfamoylbenzoic acid [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C15H12ClN3O7S MolecularWeight: 413.78968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C15H12ClN3O7S/c16-12-6-3-10(7-13(12)19(22)23)18-14(20)8-26-15(21)9-1-4-11(5-2-9)27(17,24)25/h1-7H,8H2,(H,18,20)(H2,17,24,25)