8-fluoranyl-4-oxidanylidene-1-[(5-pyrazol-1-ylpyridin-3-yl)methyl]quinoline-3-carboxylic acid

Systemtic Name: 8-fluoranyl-4-oxidanylidene-1-[(5-pyrazol-1-ylpyridin-3-yl)methyl]quinoline-3-carboxylic acid Openeye Name: 8-fluoro-4-oxo-1-[(5-pyrazol-1-yl-3-pyridyl)methyl]quinoline-3-carboxylic acid CAS Name: 8-fluoro-4-oxo-1-[[5-(1-pyrazolyl)-3-pyridinyl]methyl]-3-quinolinecarboxylic acid IUPAC Name: 8-fluoro-4-oxo-1-[(5-pyrazol-1-ylpyridin-3-yl)methyl]quinoline-3-carboxylic acid Traditional Name: 8-fluoro-4-keto-1-[(5-pyrazol-1-yl-3-pyridyl)methyl]quinoline-3-carboxylic acid Formula: C19H13FN4O3 MolecularWeight: 364.329923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)F)N(C=C(C2=O)C(=O)O)CC3=CC(=CN=C3)N4C=CC=N4

Isomeric SMILES

C1=CC2=C(C(=C1)F)N(C=C(C2=O)C(=O)O)CC3=CC(=CN=C3)N4C=CC=N4

InChI

InChI=1S/C19H13FN4O3/c20-16-4-1-3-14-17(16)23(11-15(18(14)25)19(26)27)10-12-7-13(9-21-8-12)24-6-2-5-22-24/h1-9,11H,10H2,(H,26,27)