1-(phenylmethyl)-4-pyridin-4-yl-piperidine-4-carbonitrile hydrochloride

Systemtic Name: 1-(phenylmethyl)-4-pyridin-4-yl-piperidine-4-carbonitrile hydrochloride Openeye Name: 1-benzyl-4-(4-pyridyl)piperidine-4-carbonitrile hydrochloride CAS Name: 1-(phenylmethyl)-4-pyridin-4-yl-4-piperidinecarbonitrile hydrochloride IUPAC Name: 1-benzyl-4-pyridin-4-ylpiperidine-4-carbonitrile hydrochloride Traditional Name: 1-benzyl-4-(4-pyridyl)isonipecotonitrile hydrochloride Formula: C18H20ClN3 MolecularWeight: 313.8245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=NC=C2)CC3=CC=CC=C3.Cl

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=NC=C2)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C18H19N3.ClH/c19-15-18(17-6-10-20-11-7-17)8-12-21(13-9-18)14-16-4-2-1-3-5-16;/h1-7,10-11H,8-9,12-14H2;1H