5,8-bis(fluoranyl)-4-oxidanylidene-1-[(6-phenylpyridin-2-yl)methyl]quinoline-3-carboxylic acid

Systemtic Name: 5,8-bis(fluoranyl)-4-oxidanylidene-1-[(6-phenylpyridin-2-yl)methyl]quinoline-3-carboxylic acid Openeye Name: 5,8-difluoro-4-oxo-1-[(6-phenyl-2-pyridyl)methyl]quinoline-3-carboxylic acid CAS Name: 5,8-difluoro-4-oxo-1-[(6-phenyl-2-pyridinyl)methyl]-3-quinolinecarboxylic acid IUPAC Name: 5,8-difluoro-4-oxo-1-[(6-phenylpyridin-2-yl)methyl]quinoline-3-carboxylic acid Traditional Name: 5,8-difluoro-4-keto-1-[(6-phenyl-2-pyridyl)methyl]quinoline-3-carboxylic acid Formula: C22H14F2N2O3 MolecularWeight: 392.354966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CC=C2)CN3C=C(C(=O)C4=C(C=CC(=C43)F)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CC=C2)CN3C=C(C(=O)C4=C(C=CC(=C43)F)F)C(=O)O

InChI

InChI=1S/C22H14F2N2O3/c23-16-9-10-17(24)20-19(16)21(27)15(22(28)29)12-26(20)11-14-7-4-8-18(25-14)13-5-2-1-3-6-13/h1-10,12H,11H2,(H,28,29)