[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 6-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 6-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 6-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-methyl-2-phenyl-4-quinolinecarboxylic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 6-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-methyl-2-phenyl-cinchoninic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C21H17F3N2O3 MolecularWeight: 402.36649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)NCC(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)NCC(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H17F3N2O3/c1-13-7-8-17-15(9-13)16(10-18(26-17)14-5-3-2-4-6-14)20(28)29-11-19(27)25-12-21(22,23)24/h2-10H,11-12H2,1H3,(H,25,27)