2-cyano-2-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide chloride

Systemtic Name: 2-cyano-2-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide chloride Openeye Name: 2-(1-benzylpiperidin-1-ium-4-yl)-2-cyano-acetamide chloride CAS Name: 2-cyano-2-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide chloride IUPAC Name: 2-(1-benzylpiperidin-1-ium-4-yl)-2-cyanoacetamide chloride Traditional Name: 2-(1-benzylpiperidin-1-ium-4-yl)-2-cyano-acetamide chloride Formula: C15H20ClN3O MolecularWeight: 293.7918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(C#N)C(=O)N)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

C1C[NH+](CCC1C(C#N)C(=O)N)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C15H19N3O.ClH/c16-10-14(15(17)19)13-6-8-18(9-7-13)11-12-4-2-1-3-5-12;/h1-5,13-14H,6-9,11H2,(H2,17,19);1H