methyl 3-[3-(4-decoxyphenoxy)-2-oxidanyl-propyl]sulfanylpropanoate

Systemtic Name: methyl 3-[3-(4-decoxyphenoxy)-2-oxidanyl-propyl]sulfanylpropanoate Openeye Name: methyl 3-[3-(4-decoxyphenoxy)-2-hydroxy-propyl]sulfanylpropanoate CAS Name: 3-[[3-(4-decoxyphenoxy)-2-hydroxypropyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-decoxyphenoxy)-2-hydroxypropyl]sulfanylpropanoate Traditional Name: 3-[[3-(4-decoxyphenoxy)-2-hydroxy-propyl]thio]propionic acid methyl ester Formula: C23H38O5S MolecularWeight: 426.60982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)OCC(CSCCC(=O)OC)O

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)OCC(CSCCC(=O)OC)O

InChI

InChI=1S/C23H38O5S/c1-3-4-5-6-7-8-9-10-16-27-21-11-13-22(14-12-21)28-18-20(24)19-29-17-15-23(25)26-2/h11-14,20,24H,3-10,15-19H2,1-2H3