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

Systemtic Name: 6-fluoranyl-1-(2-fluoranylethyl)-8-methoxy-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluoroethyl)-8-methoxy-7-(2-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(2-fluoroethyl)-8-methoxy-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(2-fluoroethyl)-8-methoxy-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluoroethyl)-4-keto-8-methoxy-7-(2-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C22H20F2N2O4 MolecularWeight: 414.402006

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3OC)N(C=C(C4=O)C(=O)O)CCF)F

Isomeric SMILES

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3OC)N(C=C(C4=O)C(=O)O)CCF)F

InChI

InChI=1S/C22H20F2N2O4/c1-25-9-13-4-3-12(7-14(13)10-25)18-17(24)8-15-19(21(18)30-2)26(6-5-23)11-16(20(15)27)22(28)29/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,28,29)