N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-6-(trifluoromethyl)pyridine-3-carboxamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-6-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-6-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-6-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-6-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-6-(trifluoromethyl)nicotinamide Formula: C20H23F3N3O3+ MolecularWeight: 410.41013

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CN=C(C=C2)C(F)(F)F)[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CN=C(C=C2)C(F)(F)F)[NH+]3CCOCC3

InChI

InChI=1S/C20H22F3N3O3/c1-28-16-5-2-14(3-6-16)17(26-8-10-29-11-9-26)13-25-19(27)15-4-7-18(24-12-15)20(21,22)23/h2-7,12,17H,8-11,13H2,1H3,(H,25,27)/p+1/t17-/m0/s1