ethyl 2-(4-methylphenyl)-1-(phenylcarbonyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 2-(4-methylphenyl)-1-(phenylcarbonyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: ethyl 1-benzoyl-5-(piperazine-1-carbonyl)-2-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: 1-benzoyl-2-(4-methylphenyl)-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzoyl-2-(4-methylphenyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 1-benzoyl-5-(piperazine-1-carbonyl)-2-(p-tolyl)pyrrolidine-3-carboxylic acid ethyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(C1C2=CC=C(C=C2)C)C(=O)C3=CC=CC=C3)C(=O)N4CCNCC4

Isomeric SMILES

CCOC(=O)C1CC(N(C1C2=CC=C(C=C2)C)C(=O)C3=CC=CC=C3)C(=O)N4CCNCC4

InChI

InChI=1S/C26H31N3O4/c1-3-33-26(32)21-17-22(25(31)28-15-13-27-14-16-28)29(24(30)20-7-5-4-6-8-20)23(21)19-11-9-18(2)10-12-19/h4-12,21-23,27H,3,13-17H2,1-2H3