(3S,5R)-5-oxidanyl-1-(phenylmethyl)piperidine-3-carbonitrile

Systemtic Name: (3S,5R)-5-oxidanyl-1-(phenylmethyl)piperidine-3-carbonitrile Openeye Name: (3S,5R)-1-benzyl-5-hydroxy-piperidine-3-carbonitrile CAS Name: (3S,5R)-5-hydroxy-1-(phenylmethyl)-3-piperidinecarbonitrile IUPAC Name: (3S,5R)-1-benzyl-5-hydroxypiperidine-3-carbonitrile Traditional Name: (3S,5R)-1-benzyl-5-hydroxy-nipecotonitrile Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1O)CC2=CC=CC=C2)C#N

Isomeric SMILES

C1[C@@H](CN(C[C@@H]1O)CC2=CC=CC=C2)C#N

InChI

InChI=1S/C13H16N2O/c14-7-12-6-13(16)10-15(9-12)8-11-4-2-1-3-5-11/h1-5,12-13,16H,6,8-10H2/t12-,13-/m1/s1