(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethanenitrile

Systemtic Name: (2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethanenitrile Openeye Name: (2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)acetonitrile CAS Name: (2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)acetonitrile IUPAC Name: (2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylacetonitrile Traditional Name: (2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)acetonitrile Formula: C14H19N2+ MolecularWeight: 215.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C#N)[NH+]2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C#N)[NH+]2CCCCC2

InChI

InChI=1S/C14H18N2/c1-12-5-7-13(8-6-12)14(11-15)16-9-3-2-4-10-16/h5-8,14H,2-4,9-10H2,1H3/p+1/t14-/m0/s1