1-(5-cyanopyridin-2-yl)-N-[[4-[(3-methylphenyl)methoxy]phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-cyanopyridin-2-yl)-N-[[4-[(3-methylphenyl)methoxy]phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(5-cyano-2-pyridyl)-N-[[4-(m-tolylmethoxy)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridinyl)-N-[[4-[(3-methylphenyl)methoxy]phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-cyanopyridin-2-yl)-N-[[4-[(3-methylphenyl)methoxy]phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(5-cyano-2-pyridyl)-N-[4-(3-methylbenzyl)oxybenzyl]isonipecotamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC=C(C=C2)CNC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC=C(C=C2)CNC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C27H28N4O2/c1-20-3-2-4-22(15-20)19-33-25-8-5-21(6-9-25)17-30-27(32)24-11-13-31(14-12-24)26-10-7-23(16-28)18-29-26/h2-10,15,18,24H,11-14,17,19H2,1H3,(H,30,32)