tert-butyl 4-[3-(4-decoxyphenoxy)-2-oxidanyl-propyl]sulfanylbutanoate

Systemtic Name: tert-butyl 4-[3-(4-decoxyphenoxy)-2-oxidanyl-propyl]sulfanylbutanoate Openeye Name: tert-butyl 4-[3-(4-decoxyphenoxy)-2-hydroxy-propyl]sulfanylbutanoate CAS Name: 4-[[3-(4-decoxyphenoxy)-2-hydroxypropyl]thio]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(4-decoxyphenoxy)-2-hydroxypropyl]sulfanylbutanoate Traditional Name: 4-[[3-(4-decoxyphenoxy)-2-hydroxy-propyl]thio]butyric acid tert-butyl ester Formula: C27H46O5S MolecularWeight: 482.71614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H46O5S/c1-5-6-7-8-9-10-11-12-19-30-24-15-17-25(18-16-24)31-21-23(28)22-33-20-13-14-26(29)32-27(2,3)4/h15-18,23,28H,5-14,19-22H2,1-4H3