(3R,4R)-3-oxidanyl-1-(phenylmethyl)piperidine-4-carbonitrile

Systemtic Name: (3R,4R)-3-oxidanyl-1-(phenylmethyl)piperidine-4-carbonitrile Openeye Name: (3R,4R)-1-benzyl-3-hydroxy-piperidine-4-carbonitrile CAS Name: (3R,4R)-3-hydroxy-1-(phenylmethyl)-4-piperidinecarbonitrile IUPAC Name: (3R,4R)-1-benzyl-3-hydroxypiperidine-4-carbonitrile Traditional Name: (3R,4R)-1-benzyl-3-hydroxy-isonipecotonitrile Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C#N)O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(C[C@@H]([C@H]1C#N)O)CC2=CC=CC=C2

InChI

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