ethyl 4-[(5-chloranyl-2-methoxy-phenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(5-chloranyl-2-methoxy-phenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(5-chloro-2-methoxy-anilino)-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(5-chloro-2-methoxyanilino)-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-chloro-2-methoxyanilino)-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(5-chloro-2-methoxy-anilino)-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C20H16ClF3N2O3 MolecularWeight: 424.80085

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClF3N2O3/c1-3-29-19(27)14-10-25-15-8-11(20(22,23)24)4-6-13(15)18(14)26-16-9-12(21)5-7-17(16)28-2/h4-10H,3H2,1-2H3,(H,25,26)