1-cyclopropyl-6-fluoranyl-7-(3-methyl-2,3-dihydro-1H-isoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-(3-methyl-2,3-dihydro-1H-isoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-(3-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-(3-methyl-2,3-dihydro-1H-isoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-(3-methyl-2,3-dihydro-1H-isoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-(3-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C22H19FN2O3 MolecularWeight: 378.396263

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CN1)C=CC(=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

CC1C2=C(CN1)C=CC(=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C22H19FN2O3/c1-11-15-6-12(2-3-13(15)9-24-11)16-8-20-17(7-19(16)23)21(26)18(22(27)28)10-25(20)14-4-5-14/h2-3,6-8,10-11,14,24H,4-5,9H2,1H3,(H,27,28)