1-[2,4-bis(fluoranyl)phenyl]-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(2,4-difluorophenyl)-6-fluoro-7-isoindolin-5-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(2,4-difluorophenyl)-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(2,4-difluorophenyl)-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2,4-difluorophenyl)-6-fluoro-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C24H15F3N2O3 MolecularWeight: 436.38271

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1)C=C(C=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5=C(C=C(C=C5)F)F)F

Isomeric SMILES

C1C2=C(CN1)C=C(C=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5=C(C=C(C=C5)F)F)F

InChI

InChI=1S/C24H15F3N2O3/c25-15-3-4-21(20(27)6-15)29-11-18(24(31)32)23(30)17-7-19(26)16(8-22(17)29)12-1-2-13-9-28-10-14(13)5-12/h1-8,11,28H,9-10H2,(H,31,32)