4-[4-[(E)-4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)but-2-enoxy]-3-fluoranyl-phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-[(E)-4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)but-2-enoxy]-3-fluoranyl-phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[(E)-4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)but-2-enoxy]-3-fluoro-phenyl]-4-oxo-butanoic acid CAS Name: 4-[4-[(E)-4-(4-acetyl-3-hydroxy-2-propylphenoxy)but-2-enoxy]-3-fluorophenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-[(E)-4-(4-acetyl-3-hydroxy-2-propylphenoxy)but-2-enoxy]-3-fluorophenyl]-4-oxobutanoic acid Traditional Name: 4-[4-[(E)-4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)but-2-enoxy]-3-fluoro-phenyl]-4-keto-butyric acid Formula: C25H27FO7 MolecularWeight: 458.476083

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC=CCOC2=C(C=C(C=C2)C(=O)CCC(=O)O)F

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OC/C=C/COC2=C(C=C(C=C2)C(=O)CCC(=O)O)F

InChI

InChI=1S/C25H27FO7/c1-3-6-19-22(11-8-18(16(2)27)25(19)31)32-13-4-5-14-33-23-10-7-17(15-20(23)26)21(28)9-12-24(29)30/h4-5,7-8,10-11,15,31H,3,6,9,12-14H2,1-2H3,(H,29,30)/b5-4+