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

Systemtic Name: 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propyl]sulfanylphenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl]sulfanylphenyl]-4-oxo-butanoic acid CAS Name: 4-[4-[[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl]thio]phenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl]sulfanylphenyl]-4-oxobutanoic acid Traditional Name: 4-[4-[[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl]thio]phenyl]-4-keto-butyric acid Formula: C24H28O7S MolecularWeight: 460.53992

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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

Isomeric SMILES

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

InChI

InChI=1S/C24H28O7S/c1-3-4-20-22(11-9-19(15(2)25)24(20)30)31-13-17(26)14-32-18-7-5-16(6-8-18)21(27)10-12-23(28)29/h5-9,11,17,26,30H,3-4,10,12-14H2,1-2H3,(H,28,29)