ethyl 4-[(2,4-dimethoxyphenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(2,4-dimethoxyphenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(2,4-dimethoxyanilino)-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(2,4-dimethoxyanilino)-8-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,4-dimethoxyanilino)-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(2,4-dimethoxyanilino)-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C21H19F3N2O4 MolecularWeight: 420.38177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)OC)OC)C=CC=C2C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)OC)OC)C=CC=C2C(F)(F)F

InChI

InChI=1S/C21H19F3N2O4/c1-4-30-20(27)14-11-25-19-13(6-5-7-15(19)21(22,23)24)18(14)26-16-9-8-12(28-2)10-17(16)29-3/h5-11H,4H2,1-3H3,(H,25,26)