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

Systemtic Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-1-(2-fluoranylcyclopropyl)-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluorocyclopropyl)-7-isoindolin-5-yl-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluorocyclopropyl)-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluorocyclopropyl)-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluorocyclopropyl)-7-isoindolin-5-yl-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H18F2N2O4 MolecularWeight: 412.386126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1C3=CC4=C(CNC4)C=C3)F)C(=O)C(=CN2C5CC5F)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1C3=CC4=C(CNC4)C=C3)F)C(=O)C(=CN2C5CC5F)C(=O)O

InChI

InChI=1S/C22H18F2N2O4/c1-30-21-18(10-2-3-11-7-25-8-12(11)4-10)16(24)5-13-19(21)26(17-6-15(17)23)9-14(20(13)27)22(28)29/h2-5,9,15,17,25H,6-8H2,1H3,(H,28,29)