7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-1-(2-fluoranylcyclopropyl)-8-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-1-(2-fluoranylcyclopropyl)-8-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluorocyclopropyl)-8-hydroxy-7-isoindolin-5-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluorocyclopropyl)-8-hydroxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluorocyclopropyl)-8-hydroxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluorocyclopropyl)-8-hydroxy-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C21H16F2N2O4 MolecularWeight: 398.359546

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1F)N2C=C(C(=O)C3=CC(=C(C(=C32)O)C4=CC5=C(CNC5)C=C4)F)C(=O)O

Isomeric SMILES

C1C(C1F)N2C=C(C(=O)C3=CC(=C(C(=C32)O)C4=CC5=C(CNC5)C=C4)F)C(=O)O

InChI

InChI=1S/C21H16F2N2O4/c22-14-5-16(14)25-8-13(21(28)29)19(26)12-4-15(23)17(20(27)18(12)25)9-1-2-10-6-24-7-11(10)3-9/h1-4,8,14,16,24,27H,5-7H2,(H,28,29)