[2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-oxidanylidene-1-(4-propoxycarbonylphenyl)pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-oxidanylidene-1-(4-propoxycarbonylphenyl)pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2-chloro-anilino)-2-oxo-ethyl] 5-oxo-1-(4-propoxycarbonylphenyl)pyrrolidine-3-carboxylate CAS Name: 5-oxo-1-[4-[oxo(propoxy)methyl]phenyl]-3-pyrrolidinecarboxylic acid [2-(4-bromo-2-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-chloroanilino)-2-oxoethyl] 5-oxo-1-(4-propoxycarbonylphenyl)pyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(4-propoxycarbonylphenyl)pyrrolidine-3-carboxylic acid [2-(4-bromo-2-chloro-anilino)-2-keto-ethyl] ester Formula: C23H22BrClN2O6 MolecularWeight: 537.78758

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C23H22BrClN2O6/c1-2-9-32-22(30)14-3-6-17(7-4-14)27-12-15(10-21(27)29)23(31)33-13-20(28)26-19-8-5-16(24)11-18(19)25/h3-8,11,15H,2,9-10,12-13H2,1H3,(H,26,28)