ethyl 8-ethoxy-4-[[2-(trifluoromethyl)phenyl]amino]quinoline-3-carboxylate hydrobromide

Systemtic Name: ethyl 8-ethoxy-4-[[2-(trifluoromethyl)phenyl]amino]quinoline-3-carboxylate hydrobromide Openeye Name: ethyl 8-ethoxy-4-[2-(trifluoromethyl)anilino]quinoline-3-carboxylate hydrobromide CAS Name: 8-ethoxy-4-[2-(trifluoromethyl)anilino]-3-quinolinecarboxylic acid ethyl ester hydrobromide IUPAC Name: ethyl 8-ethoxy-4-[2-(trifluoromethyl)anilino]quinoline-3-carboxylate hydrobromide Traditional Name: 8-ethoxy-4-[2-(trifluoromethyl)anilino]quinoline-3-carboxylic acid ethyl ester hydrobromide Formula: C21H20BrF3N2O3 MolecularWeight: 485.29431

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C(C(=CN=C21)C(=O)OCC)NC3=CC=CC=C3C(F)(F)F.Br

Isomeric SMILES

CCOC1=CC=CC2=C(C(=CN=C21)C(=O)OCC)NC3=CC=CC=C3C(F)(F)F.Br

InChI

InChI=1S/C21H19F3N2O3.BrH/c1-3-28-17-11-7-8-13-18(14(12-25-19(13)17)20(27)29-4-2)26-16-10-6-5-9-15(16)21(22,23)24;/h5-12H,3-4H2,1-2H3,(H,25,26);1H