(2R)-2-(2,3-dimethoxyphenyl)-2-piperidin-1-ium-1-yl-ethanenitrile

Systemtic Name: (2R)-2-(2,3-dimethoxyphenyl)-2-piperidin-1-ium-1-yl-ethanenitrile Openeye Name: (2R)-2-(2,3-dimethoxyphenyl)-2-piperidin-1-ium-1-yl-acetonitrile CAS Name: (2R)-2-(2,3-dimethoxyphenyl)-2-(1-piperidin-1-iumyl)acetonitrile IUPAC Name: (2R)-2-(2,3-dimethoxyphenyl)-2-piperidin-1-ium-1-ylacetonitrile Traditional Name: (2R)-2-(2,3-dimethoxyphenyl)-2-piperidin-1-ium-1-yl-acetonitrile Formula: C15H21N2O2+ MolecularWeight: 261.33944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C#N)[NH+]2CCCCC2

Isomeric SMILES

COC1=CC=CC(=C1OC)[C@H](C#N)[NH+]2CCCCC2

InChI

InChI=1S/C15H20N2O2/c1-18-14-8-6-7-12(15(14)19-2)13(11-16)17-9-4-3-5-10-17/h6-8,13H,3-5,9-10H2,1-2H3/p+1/t13-/m0/s1