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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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