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

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-3-chloro-2-methyl-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-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloro-2-methylanilino)-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-2-methyl-anilino)-2-keto-ethyl] ester Formula: C22H22BrClN2O4 MolecularWeight: 493.77808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrClN2O4/c1-3-14-4-6-16(7-5-14)26-11-15(10-20(26)28)22(29)30-12-19(27)25-18-9-8-17(23)21(24)13(18)2/h4-9,15H,3,10-12H2,1-2H3,(H,25,27)