[1-oxidanylidene-1-[[4-(trifluoromethyloxy)phenyl]amino]propan-2-yl] quinoline-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-[[4-(trifluoromethyloxy)phenyl]amino]propan-2-yl] quinoline-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [1-oxo-1-[4-(trifluoromethoxy)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-[4-(trifluoromethoxy)anilino]propan-2-yl] quinoline-2-carboxylate Traditional Name: quinaldic acid [2-keto-1-methyl-2-[4-(trifluoromethoxy)anilino]ethyl] ester Formula: C20H15F3N2O4 MolecularWeight: 404.33931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)OC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)OC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H15F3N2O4/c1-12(18(26)24-14-7-9-15(10-8-14)29-20(21,22)23)28-19(27)17-11-6-13-4-2-3-5-16(13)25-17/h2-12H,1H3,(H,24,26)