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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-(4-fluoranyl-2,3-dihydro-1H-isoindol-5-yl)-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-(4-fluoroisoindolin-5-yl)-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-(4-fluoro-2,3-dihydro-1H-isoindol-5-yl)-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-(4-fluoro-2,3-dihydro-1H-isoindol-5-yl)-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-(4-fluoroisoindolin-5-yl)-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H18F2N2O4 MolecularWeight: 412.386126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1C3=C(C4=C(CNC4)C=C3)F)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1C3=C(C4=C(CNC4)C=C3)F)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C22H18F2N2O4/c1-30-21-17(12-5-2-10-7-25-8-14(10)18(12)24)16(23)6-13-19(21)26(11-3-4-11)9-15(20(13)27)22(28)29/h2,5-6,9,11,25H,3-4,7-8H2,1H3,(H,28,29)