2-ethylhexyl 10-sulfooxyoctadecanoate

Systemtic Name: 2-ethylhexyl 10-sulfooxyoctadecanoate Openeye Name: 2-ethylhexyl 10-sulfooxyoctadecanoate CAS Name: 10-sulfooxyoctadecanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 10-sulfooxyoctadecanoate Traditional Name: 10-sulfoxystearic acid 2-ethylhexyl ester Formula: C26H52O6S MolecularWeight: 492.75248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCCC(=O)OCC(CC)CCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCC(CCCCCCCCC(=O)OCC(CC)CCCC)OS(=O)(=O)O

InChI

InChI=1S/C26H52O6S/c1-4-7-9-10-13-16-20-25(32-33(28,29)30)21-17-14-11-12-15-18-22-26(27)31-23-24(6-3)19-8-5-2/h24-25H,4-23H2,1-3H3,(H,28,29,30)