(3S)-N-(2-methylpropyl)-1-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2-methylpropyl)-1-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide Openeye Name: (3S)-1-(1-benzyl-4-piperidyl)-N-isobutyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2-methylpropyl)-1-[1-(phenylmethyl)-4-piperidinyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(1-benzylpiperidin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(1-benzyl-4-piperidyl)-N-isobutyl-nipecotamide Formula: C22H35N3O MolecularWeight: 357.5328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1CCCN(C1)C2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CNC(=O)[C@H]1CCCN(C1)C2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H35N3O/c1-18(2)15-23-22(26)20-9-6-12-25(17-20)21-10-13-24(14-11-21)16-19-7-4-3-5-8-19/h3-5,7-8,18,20-21H,6,9-17H2,1-2H3,(H,23,26)/t20-/m0/s1