ethyl 4-[(4-ethoxycarbonylphenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(4-ethoxycarbonylphenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(4-ethoxycarbonylanilino)-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(4-ethoxycarbonylanilino)-8-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxycarbonylanilino)-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(4-carbethoxyanilino)-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C22H19F3N2O4 MolecularWeight: 432.39247

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)OCC)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)OCC)C(F)(F)F

InChI

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