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

Systemtic Name: [2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-oxidanylidene-1-(1-phenylethyl)pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2-chloro-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-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-chloroanilino)-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-chloro-anilino)-2-keto-ethyl] ester Formula: C21H20BrClN2O4 MolecularWeight: 479.7515

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C21H20BrClN2O4/c1-13(14-5-3-2-4-6-14)25-11-15(9-20(25)27)21(28)29-12-19(26)24-18-8-7-16(22)10-17(18)23/h2-8,10,13,15H,9,11-12H2,1H3,(H,24,26)