[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 2-ethylquinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 2-ethylquinoline-4-carboxylate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 2-ethylquinoline-4-carboxylate CAS Name: 2-ethyl-4-quinolinecarboxylic acid [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 2-ethylquinoline-4-carboxylate Traditional Name: 2-ethylcinchoninic acid [2-keto-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C21H17F3N2O3 MolecularWeight: 402.36649

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H17F3N2O3/c1-2-14-11-17(16-8-3-4-9-18(16)25-14)20(28)29-12-19(27)26-15-7-5-6-13(10-15)21(22,23)24/h3-11H,2,12H2,1H3,(H,26,27)