5-fluoranyl-4-oxidanylidene-1-[[5-(6-oxidanylidene-1H-pyridin-3-yl)pyridin-2-yl]methyl]quinoline-3-carboxylic acid

Systemtic Name: 5-fluoranyl-4-oxidanylidene-1-[[5-(6-oxidanylidene-1H-pyridin-3-yl)pyridin-2-yl]methyl]quinoline-3-carboxylic acid Openeye Name: 5-fluoro-4-oxo-1-[[5-(6-oxo-1H-pyridin-3-yl)-2-pyridyl]methyl]quinoline-3-carboxylic acid CAS Name: 5-fluoro-4-oxo-1-[[5-(6-oxo-1H-pyridin-3-yl)-2-pyridinyl]methyl]-3-quinolinecarboxylic acid IUPAC Name: 5-fluoro-4-oxo-1-[[5-(6-oxo-1H-pyridin-3-yl)pyridin-2-yl]methyl]quinoline-3-carboxylic acid Traditional Name: 5-fluoro-4-keto-1-[[5-(6-keto-1H-pyridin-3-yl)-2-pyridyl]methyl]quinoline-3-carboxylic acid Formula: C21H14FN3O4 MolecularWeight: 391.351963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)F)C(=O)C(=CN2CC3=NC=C(C=C3)C4=CNC(=O)C=C4)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)F)C(=O)C(=CN2CC3=NC=C(C=C3)C4=CNC(=O)C=C4)C(=O)O

InChI

InChI=1S/C21H14FN3O4/c22-16-2-1-3-17-19(16)20(27)15(21(28)29)11-25(17)10-14-6-4-12(8-23-14)13-5-7-18(26)24-9-13/h1-9,11H,10H2,(H,24,26)(H,28,29)