6-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1H-pyridine-3-carboxamide

Systemtic Name: 6-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1H-pyridine-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-6-oxo-1H-pyridine-3-carboxamide CAS Name: 6-oxo-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1H-pyridine-3-carboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-6-oxo-1H-pyridine-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-6-keto-1H-pyridine-3-carboxamide Formula: C18H22N3O2+ MolecularWeight: 312.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CNC(=O)C=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CNC(=O)C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O2/c22-17-7-6-15(12-19-17)18(23)20-16-8-10-21(11-9-16)13-14-4-2-1-3-5-14/h1-7,12,16H,8-11,13H2,(H,19,22)(H,20,23)/p+1