[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 4-chloranyl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 4-chloranyl-3-nitro-benzoate Openeye Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [2-keto-2-(4-sulfamoylanilino)ethyl] ester Formula: C15H12ClN3O7S MolecularWeight: 413.78968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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