tert-butyl 4-(4-phenylpiperazin-1-yl)-2-pyrrolidin-1-ylcarbonyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-phenylpiperazin-1-yl)-2-pyrrolidin-1-ylcarbonyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(4-phenylpiperazin-1-yl)-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(1-pyrrolidinyl)methyl]-4-(4-phenyl-1-piperazinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-phenylpiperazin-1-yl)-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(4-phenylpiperazino)-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C24H36N4O3 MolecularWeight: 428.56764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H36N4O3/c1-24(2,3)31-23(30)28-18-20(17-21(28)22(29)27-11-7-8-12-27)26-15-13-25(14-16-26)19-9-5-4-6-10-19/h4-6,9-10,20-21H,7-8,11-18H2,1-3H3