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

Systemtic Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-1-(2-fluoranylethyl)-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluoroethyl)-7-isoindolin-5-yl-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluoroethyl)-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluoroethyl)-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluoroethyl)-7-isoindolin-5-yl-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C21H18F2N2O4 MolecularWeight: 400.375426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1C3=CC4=C(CNC4)C=C3)F)C(=O)C(=CN2CCF)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1C3=CC4=C(CNC4)C=C3)F)C(=O)C(=CN2CCF)C(=O)O

InChI

InChI=1S/C21H18F2N2O4/c1-29-20-17(11-2-3-12-8-24-9-13(12)6-11)16(23)7-14-18(20)25(5-4-22)10-15(19(14)26)21(27)28/h2-3,6-7,10,24H,4-5,8-9H2,1H3,(H,27,28)