ethyl 4-[(3-fluoranyl-4-methyl-phenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(3-fluoranyl-4-methyl-phenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(3-fluoro-4-methyl-anilino)-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(3-fluoro-4-methylanilino)-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-fluoro-4-methylanilino)-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(3-fluoro-4-methyl-anilino)-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C20H16F4N2O2 MolecularWeight: 392.346853

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=CC(=C(C=C3)C)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=CC(=C(C=C3)C)F)C(F)(F)F

InChI

InChI=1S/C20H16F4N2O2/c1-3-28-19(27)15-10-25-17-8-12(20(22,23)24)5-7-14(17)18(15)26-13-6-4-11(2)16(21)9-13/h4-10H,3H2,1-2H3,(H,25,26)