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

Systemtic Name: 1-[[5-[3-(dimethylamino)phenyl]pyridin-2-yl]methyl]-8-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-[[5-[3-(dimethylamino)phenyl]-2-pyridyl]methyl]-8-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-[[5-[3-(dimethylamino)phenyl]-2-pyridinyl]methyl]-8-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-[[5-[3-(dimethylamino)phenyl]pyridin-2-yl]methyl]-8-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-[[5-[3-(dimethylamino)phenyl]-2-pyridyl]methyl]-8-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C24H20FN3O3 MolecularWeight: 417.432303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20FN3O3/c1-27(2)18-6-3-5-15(11-18)16-9-10-17(26-12-16)13-28-14-20(24(30)31)23(29)19-7-4-8-21(25)22(19)28/h3-12,14H,13H2,1-2H3,(H,30,31)