8-[bis(fluoranyl)methoxy]-1-ethyl-6-fluoranyl-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-[bis(fluoranyl)methoxy]-1-ethyl-6-fluoranyl-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-(difluoromethoxy)-1-ethyl-6-fluoro-7-(2-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-(difluoromethoxy)-1-ethyl-6-fluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-(difluoromethoxy)-1-ethyl-6-fluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-(difluoromethoxy)-1-ethyl-6-fluoro-4-keto-7-(2-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C22H19F3N2O4 MolecularWeight: 432.39247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OC(F)F)C3=CC4=C(CN(C4)C)C=C3)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OC(F)F)C3=CC4=C(CN(C4)C)C=C3)F)C(=O)O

InChI

InChI=1S/C22H19F3N2O4/c1-3-27-10-15(21(29)30)19(28)14-7-16(23)17(20(18(14)27)31-22(24)25)11-4-5-12-8-26(2)9-13(12)6-11/h4-7,10,22H,3,8-9H2,1-2H3,(H,29,30)