1-[[5-[6-(dimethylamino)pyridin-3-yl]pyridin-2-yl]methyl]-8-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-[[5-[6-(dimethylamino)pyridin-3-yl]pyridin-2-yl]methyl]-8-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-[[5-[6-(dimethylamino)-3-pyridyl]-2-pyridyl]methyl]-8-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-[[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]methyl]-8-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-[[5-[6-(dimethylamino)pyridin-3-yl]pyridin-2-yl]methyl]-8-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-[[5-[6-(dimethylamino)-3-pyridyl]-2-pyridyl]methyl]-8-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C23H19FN4O3 MolecularWeight: 418.420363

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)C2=CN=C(C=C2)CN3C=C(C(=O)C4=C3C(=CC=C4)F)C(=O)O

Isomeric SMILES

CN(C)C1=NC=C(C=C1)C2=CN=C(C=C2)CN3C=C(C(=O)C4=C3C(=CC=C4)F)C(=O)O

InChI

InChI=1S/C23H19FN4O3/c1-27(2)20-9-7-15(11-26-20)14-6-8-16(25-10-14)12-28-13-18(23(30)31)22(29)17-4-3-5-19(24)21(17)28/h3-11,13H,12H2,1-2H3,(H,30,31)