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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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