4-[(E)-4-(2-carboxy-6-fluoranyl-quinolin-4-yl)oxybut-2-enoxy]-6-fluoranyl-quinoline-2-carboxylic acid

Systemtic Name: 4-[(E)-4-(2-carboxy-6-fluoranyl-quinolin-4-yl)oxybut-2-enoxy]-6-fluoranyl-quinoline-2-carboxylic acid Openeye Name: 4-[(E)-4-[(2-carboxy-6-fluoro-4-quinolyl)oxy]but-2-enoxy]-6-fluoro-quinoline-2-carboxylic acid CAS Name: 4-[(E)-4-[(2-carboxy-6-fluoro-4-quinolinyl)oxy]but-2-enoxy]-6-fluoro-2-quinolinecarboxylic acid IUPAC Name: 4-[(E)-4-(2-carboxy-6-fluoroquinolin-4-yl)oxybut-2-enoxy]-6-fluoroquinoline-2-carboxylic acid Traditional Name: 4-[(E)-4-[(2-carboxy-6-fluoro-4-quinolyl)oxy]but-2-enoxy]-6-fluoro-quinaldic acid Formula: C24H16F2N2O6 MolecularWeight: 466.390446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)C(=CC(=N2)C(=O)O)OCC=CCOC3=CC(=NC4=C3C=C(C=C4)F)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1F)C(=CC(=N2)C(=O)O)OC/C=C/COC3=CC(=NC4=C3C=C(C=C4)F)C(=O)O

InChI

InChI=1S/C24H16F2N2O6/c25-13-3-5-17-15(9-13)21(11-19(27-17)23(29)30)33-7-1-2-8-34-22-12-20(24(31)32)28-18-6-4-14(26)10-16(18)22/h1-6,9-12H,7-8H2,(H,29,30)(H,31,32)/b2-1+