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

Systemtic Name: 1-cyclopropyl-7-(6-fluoranyl-2,3-dihydro-1H-isoindol-5-yl)-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(6-fluoroisoindolin-5-yl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(6-fluoro-2,3-dihydro-1H-isoindol-5-yl)-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(6-fluoro-2,3-dihydro-1H-isoindol-5-yl)-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(6-fluoroisoindolin-5-yl)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C22H19FN2O3 MolecularWeight: 378.396263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(CNC5)C=C4F

Isomeric SMILES

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(CNC5)C=C4F

InChI

InChI=1S/C22H19FN2O3/c1-11-15(17-6-12-8-24-9-13(12)7-19(17)23)4-5-16-20(11)25(14-2-3-14)10-18(21(16)26)22(27)28/h4-7,10,14,24H,2-3,8-9H2,1H3,(H,27,28)