N-[(4-chlorophenyl)methyl]-N-methyl-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-N-methyl-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-N-methyl-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-N-methyl-1-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-N-methyl-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide Traditional Name: N-(4-chlorobenzyl)-N-methyl-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]isonipecotamide Formula: C20H22ClF3N3O+ MolecularWeight: 412.85639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Cl)C(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(CC1=CC=C(C=C1)Cl)C(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H21ClF3N3O/c1-26(13-14-2-5-17(21)6-3-14)19(28)15-8-10-27(11-9-15)18-7-4-16(12-25-18)20(22,23)24/h2-7,12,15H,8-11,13H2,1H3/p+1