3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)propylsulfanylmethyl]-2-ethyl-1,3-oxathiolan-2-yl]propanoic acid

Systemtic Name: 3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)propylsulfanylmethyl]-2-ethyl-1,3-oxathiolan-2-yl]propanoic acid Openeye Name: 3-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenyl)propylsulfanylmethyl]-2-ethyl-1,3-oxathiolan-2-yl]propanoic acid CAS Name: 3-[4-[[3-(4-acetyl-3-hydroxy-2-propylphenyl)propylthio]methyl]-2-ethyl-1,3-oxathiolan-2-yl]propanoic acid IUPAC Name: 3-[4-[3-(4-acetyl-3-hydroxy-2-propylphenyl)propylsulfanylmethyl]-2-ethyl-1,3-oxathiolan-2-yl]propanoic acid Traditional Name: 3-[4-[[3-(4-acetyl-3-hydroxy-2-propyl-phenyl)propylthio]methyl]-2-ethyl-1,3-oxathiolan-2-yl]propionic acid Formula: C23H34O5S2 MolecularWeight: 454.64306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)CCCSCC2COC(S2)(CC)CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)CCCSCC2COC(S2)(CC)CCC(=O)O

InChI

InChI=1S/C23H34O5S2/c1-4-7-20-17(9-10-19(16(3)24)22(20)27)8-6-13-29-15-18-14-28-23(5-2,30-18)12-11-21(25)26/h9-10,18,27H,4-8,11-15H2,1-3H3,(H,25,26)