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

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-3-chloro-anilino)-2-oxo-ethyl] 1-(4-ethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-ethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloroanilino)-2-oxoethyl] 1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(4-ethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(4-bromo-3-chloro-anilino)-2-keto-ethyl] ester Formula: C21H20BrClN2O4 MolecularWeight: 479.7515

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

InChI

InChI=1S/C21H20BrClN2O4/c1-2-13-3-6-16(7-4-13)25-11-14(9-20(25)27)21(28)29-12-19(26)24-15-5-8-17(22)18(23)10-15/h3-8,10,14H,2,9,11-12H2,1H3,(H,24,26)