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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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