(3S)-1-[1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]piperidine-3-carboxamide Openeye Name: (3S)-1-[1-[4-(5-phenylpentanoylamino)phenyl]-4-piperidyl]piperidine-3-carboxamide CAS Name: (3S)-1-[1-[4-[(1-oxo-5-phenylpentyl)amino]phenyl]-4-piperidinyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]piperidine-3-carboxamide Traditional Name: (3S)-1-[1-[4-(5-phenylpentanoylamino)phenyl]-4-piperidyl]nipecotamide Formula: C28H38N4O2 MolecularWeight: 462.62692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CCN(CC2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C[C@@H](CN(C1)C2CCN(CC2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C28H38N4O2/c29-28(34)23-10-6-18-32(21-23)26-16-19-31(20-17-26)25-14-12-24(13-15-25)30-27(33)11-5-4-9-22-7-2-1-3-8-22/h1-3,7-8,12-15,23,26H,4-6,9-11,16-21H2,(H2,29,34)(H,30,33)/t23-/m0/s1