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

Systemtic Name: methyl 2-(4-methylphenyl)-5-piperazin-1-ylcarbonyl-1-(propan-2-ylcarbamoyl)pyrrolidine-3-carboxylate Openeye Name: methyl 1-(isopropylcarbamoyl)-5-(piperazine-1-carbonyl)-2-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: 2-(4-methylphenyl)-5-[oxo(1-piperazinyl)methyl]-1-[oxo-(propan-2-ylamino)methyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-methylphenyl)-5-(piperazine-1-carbonyl)-1-(propan-2-ylcarbamoyl)pyrrolidine-3-carboxylate Traditional Name: 1-(isopropylcarbamoyl)-5-(piperazine-1-carbonyl)-2-(p-tolyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(CC(N2C(=O)NC(C)C)C(=O)N3CCNCC3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(CC(N2C(=O)NC(C)C)C(=O)N3CCNCC3)C(=O)OC

InChI

InChI=1S/C22H32N4O4/c1-14(2)24-22(29)26-18(20(27)25-11-9-23-10-12-25)13-17(21(28)30-4)19(26)16-7-5-15(3)6-8-16/h5-8,14,17-19,23H,9-13H2,1-4H3,(H,24,29)