[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate

Systemtic Name: [2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate Openeye Name: [2-(2-nitroanilino)-2-oxo-ethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate CAS Name: 4-[(4-ethoxyphenyl)sulfonylamino]benzoic acid [2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-nitroanilino)-2-oxoethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 4-(p-phenetylsulfonylamino)benzoic acid [2-keto-2-(2-nitroanilino)ethyl] ester Formula: C23H21N3O8S MolecularWeight: 499.49314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O8S/c1-2-33-18-11-13-19(14-12-18)35(31,32)25-17-9-7-16(8-10-17)23(28)34-15-22(27)24-20-5-3-4-6-21(20)26(29)30/h3-14,25H,2,15H2,1H3,(H,24,27)