(2S)-1-cyclohexylcarbonyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-cyclohexylcarbonyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(cyclohexanecarbonyl)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[cyclohexyl(oxo)methyl]-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(cyclohexanecarbonyl)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(cyclohexanecarbonyl)-N-[2-[4-(2-methoxyphenyl)piperazino]ethyl]pyrrolidine-2-carboxamide Formula: C25H38N4O3 MolecularWeight: 442.59422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCNC(=O)C3CCCN3C(=O)C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCNC(=O)[C@@H]3CCCN3C(=O)C4CCCCC4

InChI

InChI=1S/C25H38N4O3/c1-32-23-12-6-5-10-21(23)28-18-16-27(17-19-28)15-13-26-24(30)22-11-7-14-29(22)25(31)20-8-3-2-4-9-20/h5-6,10,12,20,22H,2-4,7-9,11,13-19H2,1H3,(H,26,30)/t22-/m0/s1