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

Systemtic Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-1-(2-fluoranylcyclopropyl)-8-(fluoranylmethoxy)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluorocyclopropyl)-8-(fluoromethoxy)-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-(fluoromethoxy)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluorocyclopropyl)-8-(fluoromethoxy)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluorocyclopropyl)-8-(fluoromethoxy)-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C22H17F3N2O4 MolecularWeight: 430.37659

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17F3N2O4/c23-9-31-21-18(10-1-2-11-6-26-7-12(11)3-10)16(25)4-13-19(21)27(17-5-15(17)24)8-14(20(13)28)22(29)30/h1-4,8,15,17,26H,5-7,9H2,(H,29,30)