1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(3-methoxyphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(3-methoxyphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-(3-methoxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(3-methoxyphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(3-methoxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-(3-methoxyphenyl)piperidin-1-ium-4-carboxamide Formula: C20H23ClFN2O2+ MolecularWeight: 377.860223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2CC[NH+](CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2CC[NH+](CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H22ClFN2O2/c1-26-16-5-2-4-15(12-16)23-20(25)14-8-10-24(11-9-14)13-17-18(21)6-3-7-19(17)22/h2-7,12,14H,8-11,13H2,1H3,(H,23,25)/p+1