N-(6-bromanyl-2-methyl-quinolin-4-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(6-bromanyl-2-methyl-quinolin-4-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(6-bromo-2-methyl-4-quinolyl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxamide CAS Name: N-(6-bromo-2-methyl-4-quinolinyl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(6-bromo-2-methylquinolin-4-yl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide Traditional Name: N-(6-bromo-2-methyl-4-quinolyl)-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxamide Formula: C22H17BrFN3O2 MolecularWeight: 454.291683

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)NC3=CC(=NC4=C3C=C(C=C4)Br)C

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)NC3=CC(=NC4=C3C=C(C=C4)Br)C

InChI

InChI=1S/C22H17BrFN3O2/c1-3-27-11-17(21(28)16-10-14(24)5-7-20(16)27)22(29)26-19-8-12(2)25-18-6-4-13(23)9-15(18)19/h4-11H,3H2,1-2H3,(H,25,26,29)