2-[5-methoxy-4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[5-methoxy-4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[5-methoxy-4-oxo-2-(1-piperidin-1-iumylmethyl)-1-pyridinyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[4-keto-5-methoxy-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C21H25F3N3O3+ MolecularWeight: 424.43671

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=CC1=O)C[NH+]2CCCCC2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CN(C(=CC1=O)C[NH+]2CCCCC2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H24F3N3O3/c1-30-19-13-27(17(11-18(19)28)12-26-8-3-2-4-9-26)14-20(29)25-16-7-5-6-15(10-16)21(22,23)24/h5-7,10-11,13H,2-4,8-9,12,14H2,1H3,(H,25,29)/p+1