[2-[(4-bromanyl-2,5-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(2,5-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-2,5-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(2,5-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2,5-dimethyl-anilino)-2-oxo-ethyl] 1-(2,5-dimethoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2,5-dimethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-2,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2,5-dimethylanilino)-2-oxoethyl] 1-(2,5-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(2,5-dimethoxyphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(4-bromo-2,5-dimethyl-anilino)-2-keto-ethyl] ester Formula: C23H25BrN2O6 MolecularWeight: 505.3584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)NC(=O)COC(=O)C2CC(=O)N(C2)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)NC(=O)COC(=O)C2CC(=O)N(C2)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C23H25BrN2O6/c1-13-8-18(14(2)7-17(13)24)25-21(27)12-32-23(29)15-9-22(28)26(11-15)19-10-16(30-3)5-6-20(19)31-4/h5-8,10,15H,9,11-12H2,1-4H3,(H,25,27)