[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]benzoate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]benzoate CAS Name: 4-[(4-chloro-3-nitrophenyl)sulfonylamino]benzoic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] 4-[(4-chloro-3-nitrophenyl)sulfonylamino]benzoate Traditional Name: 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]benzoic acid [2-(4-bromoanilino)-2-keto-ethyl] ester Formula: C21H15BrClN3O7S MolecularWeight: 568.7817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)NC2=CC=C(C=C2)Br)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)NC2=CC=C(C=C2)Br)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H15BrClN3O7S/c22-14-3-7-15(8-4-14)24-20(27)12-33-21(28)13-1-5-16(6-2-13)25-34(31,32)17-9-10-18(23)19(11-17)26(29)30/h1-11,25H,12H2,(H,24,27)