1-(4-octadecylphenyl)-2-sulfanyl-ethanol

Systemtic Name: 1-(4-octadecylphenyl)-2-sulfanyl-ethanol Openeye Name: 1-(4-octadecylphenyl)-2-sulfanyl-ethanol CAS Name: 2-mercapto-1-(4-octadecylphenyl)ethanol IUPAC Name: 1-(4-octadecylphenyl)-2-sulfanylethanol Traditional Name: 2-mercapto-1-(4-stearylphenyl)ethanol Formula: C26H46OS MolecularWeight: 406.70784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)C(CS)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)C(CS)O

InChI

InChI=1S/C26H46OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-19-21-25(22-20-24)26(27)23-28/h19-22,26-28H,2-18,23H2,1H3