1-ethyl-6-fluoranyl-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-(2-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(2-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C21H19FN2O3 MolecularWeight: 366.385563

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CC4=C(CN(C4)C)C=C3)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CC4=C(CN(C4)C)C=C3)F)C(=O)O

InChI

InChI=1S/C21H19FN2O3/c1-3-24-11-17(21(26)27)20(25)16-7-18(22)15(8-19(16)24)12-4-5-13-9-23(2)10-14(13)6-12/h4-8,11H,3,9-10H2,1-2H3,(H,26,27)