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

Systemtic Name: [2-[(4-bromanyl-2,5-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-oxidanylidene-1-(1-phenylethyl)pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2,5-dimethyl-anilino)-2-oxo-ethyl] 5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxylate CAS Name: 5-oxo-1-(1-phenylethyl)-3-pyrrolidinecarboxylic acid [2-(4-bromo-2,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2,5-dimethylanilino)-2-oxoethyl] 5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(1-phenylethyl)pyrrolidine-3-carboxylic acid [2-(4-bromo-2,5-dimethyl-anilino)-2-keto-ethyl] ester Formula: C23H25BrN2O4 MolecularWeight: 473.3596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25BrN2O4/c1-14-10-20(15(2)9-19(14)24)25-21(27)13-30-23(29)18-11-22(28)26(12-18)16(3)17-7-5-4-6-8-17/h4-10,16,18H,11-13H2,1-3H3,(H,25,27)