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

Systemtic Name: ethyl 4-[(3-methoxycarbonylphenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(3-methoxycarbonylanilino)-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(3-methoxycarbonylanilino)-8-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-methoxycarbonylanilino)-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(3-carbomethoxyanilino)-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C21H17F3N2O4 MolecularWeight: 418.36589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17F3N2O4/c1-3-30-20(28)15-11-25-18-14(8-5-9-16(18)21(22,23)24)17(15)26-13-7-4-6-12(10-13)19(27)29-2/h4-11H,3H2,1-2H3,(H,25,26)