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

Systemtic Name: 4-[4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanyl]phenyl]sulfanylphenyl]-4-oxidanyl-butanoic acid Openeye Name: 4-[4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylsulfanyl]phenyl]sulfanylphenyl]-4-hydroxy-butanoic acid CAS Name: 4-[4-[[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio]phenyl]thio]phenyl]-4-hydroxybutanoic acid IUPAC Name: 4-[4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylsulfanyl]phenyl]sulfanylphenyl]-4-hydroxybutanoic acid Traditional Name: 4-[4-[[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylthio]phenyl]thio]phenyl]-4-hydroxy-butyric acid Formula: C30H34O6S2 MolecularWeight: 554.71736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC2=CC=C(C=C2)SC3=CC=C(C=C3)C(CCC(=O)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC2=CC=C(C=C2)SC3=CC=C(C=C3)C(CCC(=O)O)O

InChI

InChI=1S/C30H34O6S2/c1-3-5-26-28(16-14-25(20(2)31)30(26)35)36-18-4-19-37-22-10-12-24(13-11-22)38-23-8-6-21(7-9-23)27(32)15-17-29(33)34/h6-14,16,27,32,35H,3-5,15,17-19H2,1-2H3,(H,33,34)