ethyl 4-[(4-ethoxyphenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(4-ethoxyphenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(4-ethoxyanilino)-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(4-ethoxyanilino)-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxyanilino)-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(p-phenetidino)-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C21H19F3N2O3 MolecularWeight: 404.38237

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C(=O)OCC)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C(=O)OCC)C(F)(F)F

InChI

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