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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-(2-methylisoindolin-5-yl)-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-(2-methylisoindolin-5-yl)-8-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C23H18F4N2O3 MolecularWeight: 446.394233

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3C(F)(F)F)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3C(F)(F)F)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C23H18F4N2O3/c1-28-8-12-3-2-11(6-13(12)9-28)18-17(24)7-15-20(19(18)23(25,26)27)29(14-4-5-14)10-16(21(15)30)22(31)32/h2-3,6-7,10,14H,4-5,8-9H2,1H3,(H,31,32)