3-[[(3R,5S)-5-(phenylmethyl)piperidin-3-yl]oxymethyl]benzenecarbonitrile

Systemtic Name: 3-[[(3R,5S)-5-(phenylmethyl)piperidin-3-yl]oxymethyl]benzenecarbonitrile Openeye Name: 3-[[(3R,5S)-5-benzyl-3-piperidyl]oxymethyl]benzonitrile CAS Name: 3-[[(3R,5S)-5-(phenylmethyl)-3-piperidinyl]oxymethyl]benzonitrile IUPAC Name: 3-[[(3R,5S)-5-benzylpiperidin-3-yl]oxymethyl]benzonitrile Traditional Name: 3-[[(3R,5S)-5-benzyl-3-piperidyl]oxymethyl]benzonitrile Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNCC1OCC2=CC=CC(=C2)C#N)CC3=CC=CC=C3

Isomeric SMILES

C1[C@@H](CNC[C@@H]1OCC2=CC=CC(=C2)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O/c21-12-17-7-4-8-18(10-17)15-23-20-11-19(13-22-14-20)9-16-5-2-1-3-6-16/h1-8,10,19-20,22H,9,11,13-15H2/t19-,20+/m0/s1