[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 1-[(4-bromophenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 1-[(4-bromophenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(2,4-dimethoxyanilino)-2-oxo-ethyl] 1-[(4-bromobenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[[(4-bromophenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylic acid [2-(2,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyanilino)-2-oxoethyl] 1-[(4-bromobenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-[(4-bromobenzoyl)amino]-5-keto-pyrrolidine-3-carboxylic acid [2-(2,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C22H22BrN3O7 MolecularWeight: 520.32998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)NC(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)NC(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C22H22BrN3O7/c1-31-16-7-8-17(18(10-16)32-2)24-19(27)12-33-22(30)14-9-20(28)26(11-14)25-21(29)13-3-5-15(23)6-4-13/h3-8,10,14H,9,11-12H2,1-2H3,(H,24,27)(H,25,29)