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

Systemtic Name: [2-[(4-bromanyl-2-ethyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-oxidanylidene-1-(1-phenylethyl)pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2-ethyl-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-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-ethylanilino)-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-ethyl-anilino)-2-keto-ethyl] ester Formula: C23H25BrN2O4 MolecularWeight: 473.3596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=O)COC(=O)C2CC(=O)N(C2)C(C)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=O)COC(=O)C2CC(=O)N(C2)C(C)C3=CC=CC=C3

InChI

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