8-fluoranyl-1-[[4-[6-(methylamino)pyridin-3-yl]phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-fluoranyl-1-[[4-[6-(methylamino)pyridin-3-yl]phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-fluoro-1-[[4-[6-(methylamino)-3-pyridyl]phenyl]methyl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-fluoro-1-[[4-[6-(methylamino)-3-pyridinyl]phenyl]methyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-fluoro-1-[[4-[6-(methylamino)pyridin-3-yl]phenyl]methyl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-fluoro-4-keto-1-[4-[6-(methylamino)-3-pyridyl]benzyl]quinoline-3-carboxylic acid Formula: C23H18FN3O3 MolecularWeight: 403.405723

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(C=C1)C2=CC=C(C=C2)CN3C=C(C(=O)C4=C3C(=CC=C4)F)C(=O)O

Isomeric SMILES

CNC1=NC=C(C=C1)C2=CC=C(C=C2)CN3C=C(C(=O)C4=C3C(=CC=C4)F)C(=O)O

InChI

InChI=1S/C23H18FN3O3/c1-25-20-10-9-16(11-26-20)15-7-5-14(6-8-15)12-27-13-18(23(29)30)22(28)17-3-2-4-19(24)21(17)27/h2-11,13H,12H2,1H3,(H,25,26)(H,29,30)