methyl 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanyl]-3-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-2-methyl-phenyl]butanoate

Systemtic Name: methyl 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanyl]-3-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-2-methyl-phenyl]butanoate Openeye Name: methyl 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylsulfanyl]-3-(3-methoxy-3-oxo-propyl)sulfanyl-2-methyl-phenyl]butanoate CAS Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio]-3-[(3-methoxy-3-oxopropyl)thio]-2-methylphenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylsulfanyl]-3-(3-methoxy-3-oxopropyl)sulfanyl-2-methylphenyl]butanoate Traditional Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylthio]-3-[(3-keto-3-methoxy-propyl)thio]-2-methyl-phenyl]butyric acid methyl ester Formula: C30H40O7S2 MolecularWeight: 576.7644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC2=C(C(=C(C=C2)CCCC(=O)OC)C)SCCC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC2=C(C(=C(C=C2)CCCC(=O)OC)C)SCCC(=O)OC

InChI

InChI=1S/C30H40O7S2/c1-6-9-24-25(14-13-23(21(3)31)29(24)34)37-17-8-18-38-26-15-12-22(10-7-11-27(32)35-4)20(2)30(26)39-19-16-28(33)36-5/h12-15,34H,6-11,16-19H2,1-5H3