3-[1-(1H-imidazol-2-ylmethyl)piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide

Systemtic Name: 3-[1-(1H-imidazol-2-ylmethyl)piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide Openeye Name: 3-[1-(1H-imidazol-2-ylmethyl)piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide CAS Name: 3-[1-(1H-imidazol-2-ylmethyl)-4-piperidin-1-iumyl]-N-(3-methoxyphenyl)propanamide IUPAC Name: 3-[1-(1H-imidazol-2-ylmethyl)piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide Traditional Name: 3-[1-(1H-imidazol-2-ylmethyl)piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propionamide Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CCC2CC[NH+](CC2)CC3=NC=CN3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CCC2CC[NH+](CC2)CC3=NC=CN3

InChI

InChI=1S/C19H26N4O2/c1-25-17-4-2-3-16(13-17)22-19(24)6-5-15-7-11-23(12-8-15)14-18-20-9-10-21-18/h2-4,9-10,13,15H,5-8,11-12,14H2,1H3,(H,20,21)(H,22,24)/p+1