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

Systemtic Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-isoindolin-5-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C20H17FN2O3 MolecularWeight: 352.358983

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CC4=C(CNC4)C=C3)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CC4=C(CNC4)C=C3)F)C(=O)O

InChI

InChI=1S/C20H17FN2O3/c1-2-23-10-16(20(25)26)19(24)15-6-17(21)14(7-18(15)23)11-3-4-12-8-22-9-13(12)5-11/h3-7,10,22H,2,8-9H2,1H3,(H,25,26)