N-(pyridin-4-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-(pyridin-4-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-(4-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-(pyridin-4-ylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-(pyridin-4-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-(4-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C12H18N3O+ MolecularWeight: 220.29082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C(=O)NCC2=CC=NC=C2

Isomeric SMILES

C1C[NH2+]CCC1C(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C12H17N3O/c16-12(11-3-7-14-8-4-11)15-9-10-1-5-13-6-2-10/h1-2,5-6,11,14H,3-4,7-9H2,(H,15,16)/p+1