N-(4-bromanyl-2-fluoranyl-phenyl)-1-ethyl-4-oxidanylidene-6-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-ethyl-4-oxidanylidene-6-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-ethyl-4-oxo-6-(trifluoromethyl)quinoline-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-ethyl-4-oxo-6-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-ethyl-4-oxo-6-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-ethyl-4-keto-6-(trifluoromethyl)quinoline-3-carboxamide Formula: C19H13BrF4N2O2 MolecularWeight: 457.216333

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C19H13BrF4N2O2/c1-2-26-9-13(18(28)25-15-5-4-11(20)8-14(15)21)17(27)12-7-10(19(22,23)24)3-6-16(12)26/h3-9H,2H2,1H3,(H,25,28)