methyl 4-[4-[3-(4-ethanoyl-3-methoxy-2-propyl-phenoxy)propylsulfanylmethyl]-2-methyl-1,3-dithiolan-2-yl]butanoate

Systemtic Name: methyl 4-[4-[3-(4-ethanoyl-3-methoxy-2-propyl-phenoxy)propylsulfanylmethyl]-2-methyl-1,3-dithiolan-2-yl]butanoate Openeye Name: methyl 4-[4-[3-(4-acetyl-3-methoxy-2-propyl-phenoxy)propylsulfanylmethyl]-2-methyl-1,3-dithiolan-2-yl]butanoate CAS Name: 4-[4-[[3-(4-acetyl-3-methoxy-2-propylphenoxy)propylthio]methyl]-2-methyl-1,3-dithiolan-2-yl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[3-(4-acetyl-3-methoxy-2-propylphenoxy)propylsulfanylmethyl]-2-methyl-1,3-dithiolan-2-yl]butanoate Traditional Name: 4-[4-[[3-(4-acetyl-3-methoxy-2-propyl-phenoxy)propylthio]methyl]-2-methyl-1,3-dithiolan-2-yl]butyric acid methyl ester Formula: C25H38O5S3 MolecularWeight: 514.76122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OC)C(=O)C)OCCCSCC2CSC(S2)(C)CCCC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1OC)C(=O)C)OCCCSCC2CSC(S2)(C)CCCC(=O)OC

InChI

InChI=1S/C25H38O5S3/c1-6-9-21-22(12-11-20(18(2)26)24(21)29-5)30-14-8-15-31-16-19-17-32-25(3,33-19)13-7-10-23(27)28-4/h11-12,19H,6-10,13-17H2,1-5H3