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

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 3-methyl-2-nitro-benzoate Openeye Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid [2-keto-2-(4-sulfamoylanilino)ethyl] ester Formula: C16H15N3O7S MolecularWeight: 393.3712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H15N3O7S/c1-10-3-2-4-13(15(10)19(22)23)16(21)26-9-14(20)18-11-5-7-12(8-6-11)27(17,24)25/h2-8H,9H2,1H3,(H,18,20)(H2,17,24,25)