4-[3-(4-decoxyphenoxy)-2-oxidanylidene-propyl]sulfanylbutanoic acid

Systemtic Name: 4-[3-(4-decoxyphenoxy)-2-oxidanylidene-propyl]sulfanylbutanoic acid Openeye Name: 4-[3-(4-decoxyphenoxy)-2-oxo-propyl]sulfanylbutanoic acid CAS Name: 4-[[3-(4-decoxyphenoxy)-2-oxopropyl]thio]butanoic acid IUPAC Name: 4-[3-(4-decoxyphenoxy)-2-oxopropyl]sulfanylbutanoic acid Traditional Name: 4-[[3-(4-decoxyphenoxy)-2-keto-propyl]thio]butyric acid Formula: C23H36O5S MolecularWeight: 424.59394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36O5S/c1-2-3-4-5-6-7-8-9-16-27-21-12-14-22(15-13-21)28-18-20(24)19-29-17-10-11-23(25)26/h12-15H,2-11,16-19H2,1H3,(H,25,26)