methyl 3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoate

Systemtic Name: methyl 3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoate Openeye Name: methyl 3-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl]-4-ethyl-2-methyl-5-thioxo-1,3-dithiolan-2-yl]propanoate CAS Name: 3-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoate Traditional Name: 3-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl]-4-ethyl-2-methyl-5-thioxo-1,3-dithiolan-2-yl]propionic acid methyl ester Formula: C24H34O6S3 MolecularWeight: 514.71816

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(CC2(C(=S)SC(S2)(C)CCC(=O)OC)CC)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(CC2(C(=S)SC(S2)(C)CCC(=O)OC)CC)O

InChI

InChI=1S/C24H34O6S3/c1-6-8-18-19(10-9-17(15(3)25)21(18)28)30-14-16(26)13-24(7-2)22(31)32-23(4,33-24)12-11-20(27)29-5/h9-10,16,26,28H,6-8,11-14H2,1-5H3