N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-(2-cyanoethyl)-N-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-(2-cyanoethyl)-N-(3-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-(2-cyanoethyl)-N-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C15H21N4O+ MolecularWeight: 273.35344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C(=O)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1C[NH2+]CCC1C(=O)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C15H20N4O/c16-6-2-10-19(12-13-3-1-7-18-11-13)15(20)14-4-8-17-9-5-14/h1,3,7,11,14,17H,2,4-5,8-10,12H2/p+1