methyl 1-cyclopropylcarbonyl-2-(4-methylphenyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-cyclopropylcarbonyl-2-(4-methylphenyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-(cyclopropanecarbonyl)-5-(piperazine-1-carbonyl)-2-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: 1-[cyclopropyl(oxo)methyl]-2-(4-methylphenyl)-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(cyclopropanecarbonyl)-2-(4-methylphenyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 1-(cyclopropanecarbonyl)-5-(piperazine-1-carbonyl)-2-(p-tolyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(CC(N2C(=O)C3CC3)C(=O)N4CCNCC4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(CC(N2C(=O)C3CC3)C(=O)N4CCNCC4)C(=O)OC

InChI

InChI=1S/C22H29N3O4/c1-14-3-5-15(6-4-14)19-17(22(28)29-2)13-18(25(19)20(26)16-7-8-16)21(27)24-11-9-23-10-12-24/h3-6,16-19,23H,7-13H2,1-2H3