(3S)-1-cycloheptyl-6-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-cycloheptyl-6-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide Openeye Name: (3S)-N-(1-benzyl-4-piperidyl)-1-cycloheptyl-6-oxo-piperidine-3-carboxamide CAS Name: (3S)-1-cycloheptyl-6-oxo-N-[1-(phenylmethyl)-4-piperidinyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(1-benzylpiperidin-4-yl)-1-cycloheptyl-6-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-(1-benzyl-4-piperidyl)-1-cycloheptyl-6-keto-nipecotamide Formula: C25H37N3O2 MolecularWeight: 411.58018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CC(CCC2=O)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)N2C[C@H](CCC2=O)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H37N3O2/c29-24-13-12-21(19-28(24)23-10-6-1-2-7-11-23)25(30)26-22-14-16-27(17-15-22)18-20-8-4-3-5-9-20/h3-5,8-9,21-23H,1-2,6-7,10-19H2,(H,26,30)/t21-/m0/s1