ethyl 6-ethoxy-4-[[3-(trifluoromethyl)phenyl]amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-ethoxy-4-[[3-(trifluoromethyl)phenyl]amino]quinoline-3-carboxylate Openeye Name: ethyl 6-ethoxy-4-[3-(trifluoromethyl)anilino]quinoline-3-carboxylate CAS Name: 6-ethoxy-4-[3-(trifluoromethyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-ethoxy-4-[3-(trifluoromethyl)anilino]quinoline-3-carboxylate Traditional Name: 6-ethoxy-4-[3-(trifluoromethyl)anilino]quinoline-3-carboxylic acid ethyl ester Formula: C21H19F3N2O3 MolecularWeight: 404.38237

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H19F3N2O3/c1-3-28-15-8-9-18-16(11-15)19(17(12-25-18)20(27)29-4-2)26-14-7-5-6-13(10-14)21(22,23)24/h5-12H,3-4H2,1-2H3,(H,25,26)