N-[2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]pyridine-3-carboxamide

Systemtic Name: N-[2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]pyridine-3-carboxamide Openeye Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]ethyl]pyridine-3-carboxamide CAS Name: N-[2-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]ethyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]ethyl]pyridine-3-carboxamide Traditional Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]ethyl]nicotinamide Formula: C20H27N4O+ MolecularWeight: 339.45458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NCCNC(=O)C2=CN=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NCCNC(=O)C2=CN=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N4O/c25-20(18-7-4-10-21-15-18)23-12-11-22-19-8-13-24(14-9-19)16-17-5-2-1-3-6-17/h1-7,10,15,19,22H,8-9,11-14,16H2,(H,23,25)/p+1