1-[(3-chlorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(3-chlorobenzyl)-N-p-anisyl-piperidin-1-ium-4-carboxamide Formula: C21H26ClN2O2+ MolecularWeight: 373.89634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H25ClN2O2/c1-26-20-7-5-16(6-8-20)14-23-21(25)18-9-11-24(12-10-18)15-17-3-2-4-19(22)13-17/h2-8,13,18H,9-12,14-15H2,1H3,(H,23,25)/p+1