1-ethyl-6-fluoranyl-8-methoxy-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-8-methoxy-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-8-methoxy-7-(2-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-8-methoxy-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-8-methoxy-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-8-methoxy-7-(2-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C22H21FN2O4 MolecularWeight: 396.411543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN2O4/c1-4-25-11-16(22(27)28)20(26)15-8-17(23)18(21(29-3)19(15)25)12-5-6-13-9-24(2)10-14(13)7-12/h5-8,11H,4,9-10H2,1-3H3,(H,27,28)