[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C19H14BrN3O7S2 MolecularWeight: 540.36436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C19H14BrN3O7S2/c20-16-8-9-18(31-16)32(28,29)22-15-7-2-1-6-14(15)19(25)30-11-17(24)21-12-4-3-5-13(10-12)23(26)27/h1-10,22H,11H2,(H,21,24)