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

Systemtic Name: 1-ethyl-6-fluoranyl-8-(fluoranylmethoxy)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-8-(fluoromethoxy)-7-(2-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-8-(fluoromethoxy)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-8-(fluoromethoxy)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-8-(fluoromethoxy)-4-keto-7-(2-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C22H20F2N2O4 MolecularWeight: 414.402006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20F2N2O4/c1-3-26-10-16(22(28)29)20(27)15-7-17(24)18(21(19(15)26)30-11-23)12-4-5-13-8-25(2)9-14(13)6-12/h4-7,10H,3,8-9,11H2,1-2H3,(H,28,29)