[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 2,6-dimethylquinoline-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 2,6-dimethylquinoline-3-carboxylate Openeye Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 2,6-dimethylquinoline-3-carboxylate CAS Name: 2,6-dimethyl-3-quinolinecarboxylic acid [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 2,6-dimethylquinoline-3-carboxylate Traditional Name: 2,6-dimethylquinoline-3-carboxylic acid [2-keto-2-[4-(trifluoromethoxy)anilino]ethyl] ester Formula: C21H17F3N2O4 MolecularWeight: 418.36589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)OCC(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)OCC(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H17F3N2O4/c1-12-3-8-18-14(9-12)10-17(13(2)25-18)20(28)29-11-19(27)26-15-4-6-16(7-5-15)30-21(22,23)24/h3-10H,11H2,1-2H3,(H,26,27)