N-(2-ethoxyphenyl)-1-ethyl-4-oxidanylidene-6-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: N-(2-ethoxyphenyl)-1-ethyl-4-oxidanylidene-6-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: N-(2-ethoxyphenyl)-1-ethyl-4-oxo-6-(trifluoromethyl)quinoline-3-carboxamide CAS Name: N-(2-ethoxyphenyl)-1-ethyl-4-oxo-6-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: N-(2-ethoxyphenyl)-1-ethyl-4-oxo-6-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: 1-ethyl-4-keto-N-o-phenetyl-6-(trifluoromethyl)quinoline-3-carboxamide Formula: C21H19F3N2O3 MolecularWeight: 404.38237

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC=CC=C3OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC=CC=C3OCC

InChI

InChI=1S/C21H19F3N2O3/c1-3-26-12-15(20(28)25-16-7-5-6-8-18(16)29-4-2)19(27)14-11-13(21(22,23)24)9-10-17(14)26/h5-12H,3-4H2,1-2H3,(H,25,28)