2-[[(3S,4R)-1-butyl-4-phenyl-piperidin-3-yl]methoxy]benzenecarbonitrile

Systemtic Name: 2-[[(3S,4R)-1-butyl-4-phenyl-piperidin-3-yl]methoxy]benzenecarbonitrile Openeye Name: 2-[[(3S,4R)-1-butyl-4-phenyl-3-piperidyl]methoxy]benzonitrile CAS Name: 2-[[(3S,4R)-1-butyl-4-phenyl-3-piperidinyl]methoxy]benzonitrile IUPAC Name: 2-[[(3S,4R)-1-butyl-4-phenylpiperidin-3-yl]methoxy]benzonitrile Traditional Name: 2-[[(3S,4R)-1-butyl-4-phenyl-3-piperidyl]methoxy]benzonitrile Formula: C23H28N2O MolecularWeight: 348.48122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(C(C1)COC2=CC=CC=C2C#N)C3=CC=CC=C3

Isomeric SMILES

CCCCN1CC[C@H]([C@@H](C1)COC2=CC=CC=C2C#N)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O/c1-2-3-14-25-15-13-22(19-9-5-4-6-10-19)21(17-25)18-26-23-12-8-7-11-20(23)16-24/h4-12,21-22H,2-3,13-15,17-18H2,1H3/t21-,22-/m0/s1