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

Systemtic Name: ethyl 4-[(3-bromophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(3-bromoanilino)-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(3-bromoanilino)-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromoanilino)-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(3-bromoanilino)-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C19H14BrF3N2O2 MolecularWeight: 439.22587

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14BrF3N2O2/c1-2-27-18(26)15-10-24-16-8-11(19(21,22)23)6-7-14(16)17(15)25-13-5-3-4-12(20)9-13/h3-10H,2H2,1H3,(H,24,25)