ethyl 4-[[1-ethyl-4-oxidanylidene-6-(trifluoromethyl)quinolin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[1-ethyl-4-oxidanylidene-6-(trifluoromethyl)quinolin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[1-ethyl-4-oxo-6-(trifluoromethyl)quinoline-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-ethyl-4-oxo-6-(trifluoromethyl)-3-quinolinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-ethyl-4-oxo-6-(trifluoromethyl)quinoline-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-ethyl-4-keto-6-(trifluoromethyl)quinoline-3-carbonyl]amino]benzoic acid ethyl ester Formula: C22H19F3N2O4 MolecularWeight: 432.39247

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C22H19F3N2O4/c1-3-27-12-17(19(28)16-11-14(22(23,24)25)7-10-18(16)27)20(29)26-15-8-5-13(6-9-15)21(30)31-4-2/h5-12H,3-4H2,1-2H3,(H,26,29)