2-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanenitrile

Systemtic Name: 2-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanenitrile Openeye Name: 2-(1-benzylpiperidin-1-ium-4-yl)acetonitrile CAS Name: 2-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetonitrile IUPAC Name: 2-(1-benzylpiperidin-1-ium-4-yl)acetonitrile Traditional Name: 2-(1-benzylpiperidin-1-ium-4-yl)acetonitrile Formula: C14H19N2+ MolecularWeight: 215.31406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC#N)CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1CC#N)CC2=CC=CC=C2

InChI

InChI=1S/C14H18N2/c15-9-6-13-7-10-16(11-8-13)12-14-4-2-1-3-5-14/h1-5,13H,6-8,10-12H2/p+1