4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propyl]sulfanyl-2-oxidanyl-phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propyl]sulfanyl-2-oxidanyl-phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl]sulfanyl-2-hydroxy-phenyl]-4-oxo-butanoic acid CAS Name: 4-[4-[[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl]thio]-2-hydroxyphenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl]sulfanyl-2-hydroxyphenyl]-4-oxobutanoic acid Traditional Name: 4-[4-[[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl]thio]-2-hydroxy-phenyl]-4-keto-butyric acid Formula: C24H28O8S MolecularWeight: 476.53932

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(CSC2=CC(=C(C=C2)C(=O)CCC(=O)O)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(CSC2=CC(=C(C=C2)C(=O)CCC(=O)O)O)O

InChI

InChI=1S/C24H28O8S/c1-3-4-19-22(9-7-17(14(2)25)24(19)31)32-12-15(26)13-33-16-5-6-18(21(28)11-16)20(27)8-10-23(29)30/h5-7,9,11,15,26,28,31H,3-4,8,10,12-13H2,1-2H3,(H,29,30)