methyl 3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanylmethyl]-2-phenyl-1,3-oxathiolan-2-yl]propanoate

Systemtic Name: methyl 3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanylmethyl]-2-phenyl-1,3-oxathiolan-2-yl]propanoate Openeye Name: methyl 3-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylsulfanylmethyl]-2-phenyl-1,3-oxathiolan-2-yl]propanoate CAS Name: 3-[4-[[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio]methyl]-2-phenyl-1,3-oxathiolan-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylsulfanylmethyl]-2-phenyl-1,3-oxathiolan-2-yl]propanoate Traditional Name: 3-[4-[[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylthio]methyl]-2-phenyl-1,3-oxathiolan-2-yl]propionic acid methyl ester Formula: C28H36O6S2 MolecularWeight: 532.71184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSCC2COC(S2)(CCC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSCC2COC(S2)(CCC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C28H36O6S2/c1-4-9-24-25(13-12-23(20(2)29)27(24)31)33-16-8-17-35-19-22-18-34-28(36-22,15-14-26(30)32-3)21-10-6-5-7-11-21/h5-7,10-13,22,31H,4,8-9,14-19H2,1-3H3