octadecyl 2-sulfooxyoctanoate

Systemtic Name: octadecyl 2-sulfooxyoctanoate Openeye Name: octadecyl 2-sulfooxyoctanoate CAS Name: 2-sulfooxyoctanoic acid octadecyl ester IUPAC Name: octadecyl 2-sulfooxyoctanoate Traditional Name: 2-sulfoxycaprylic acid stearyl ester Formula: C26H52O6S MolecularWeight: 492.75248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(CCCCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(CCCCCC)OS(=O)(=O)O

InChI

InChI=1S/C26H52O6S/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-24-31-26(27)25(32-33(28,29)30)23-21-8-6-4-2/h25H,3-24H2,1-2H3,(H,28,29,30)