N-(3-methoxyphenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-(3-methoxyphenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-(3-methoxyphenyl)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]propanamide CAS Name: N-(3-methoxyphenyl)-3-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(3-methoxyphenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]propanamide Traditional Name: N-(3-methoxyphenyl)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]propionamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CCC2CC[NH+](CC2)CC3=CN=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CCC2CC[NH+](CC2)CC3=CN=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-26-20-6-2-5-19(14-20)23-21(25)8-7-17-9-12-24(13-10-17)16-18-4-3-11-22-15-18/h2-6,11,14-15,17H,7-10,12-13,16H2,1H3,(H,23,25)/p+1