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

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] 1-(3,4-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] 1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C22H23BrN2O4 MolecularWeight: 459.33302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)C)C)Br

InChI

InChI=1S/C22H23BrN2O4/c1-13-4-7-19(18(23)8-13)24-20(26)12-29-22(28)16-10-21(27)25(11-16)17-6-5-14(2)15(3)9-17/h4-9,16H,10-12H2,1-3H3,(H,24,26)