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

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-6,8-bis(fluoranyl)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(2,4-difluorophenyl)-6,8-difluoro-7-(2-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(2,4-difluorophenyl)-6,8-difluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(2,4-difluorophenyl)-6,8-difluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2,4-difluorophenyl)-6,8-difluoro-4-keto-7-(2-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C25H16F4N2O3 MolecularWeight: 468.399753

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3F)N(C=C(C4=O)C(=O)O)C5=C(C=C(C=C5)F)F)F

Isomeric SMILES

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3F)N(C=C(C4=O)C(=O)O)C5=C(C=C(C=C5)F)F)F

InChI

InChI=1S/C25H16F4N2O3/c1-30-9-13-3-2-12(6-14(13)10-30)21-19(28)8-16-23(22(21)29)31(11-17(24(16)32)25(33)34)20-5-4-15(26)7-18(20)27/h2-8,11H,9-10H2,1H3,(H,33,34)