[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]-[2-(4-pyridin-2-ylpiperazin-1-yl)carbonylcyclohexyl]methanone

Systemtic Name: [4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]-[2-(4-pyridin-2-ylpiperazin-1-yl)carbonylcyclohexyl]methanone Openeye Name: (4-benzyl-4-hydroxy-1-piperidyl)-[2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexyl]methanone CAS Name: [4-hydroxy-4-(phenylmethyl)-1-piperidinyl]-[2-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]cyclohexyl]methanone IUPAC Name: (4-benzyl-4-hydroxypiperidin-1-yl)-[2-(4-pyridin-2-ylpiperazine-1-carbonyl)cyclohexyl]methanone Traditional Name: (4-benzyl-4-hydroxy-piperidino)-[2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexyl]methanone Formula: C29H38N4O3 MolecularWeight: 490.63702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)N2CCC(CC2)(CC3=CC=CC=C3)O)C(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C1CCC(C(C1)C(=O)N2CCC(CC2)(CC3=CC=CC=C3)O)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C29H38N4O3/c34-27(32-16-13-29(36,14-17-32)22-23-8-2-1-3-9-23)24-10-4-5-11-25(24)28(35)33-20-18-31(19-21-33)26-12-6-7-15-30-26/h1-3,6-9,12,15,24-25,36H,4-5,10-11,13-14,16-22H2