2-ethyldodecyl 2-sulfooxyoctanoate

Systemtic Name: 2-ethyldodecyl 2-sulfooxyoctanoate Openeye Name: 2-ethyldodecyl 2-sulfooxyoctanoate CAS Name: 2-sulfooxyoctanoic acid 2-ethyldodecyl ester IUPAC Name: 2-ethyldodecyl 2-sulfooxyoctanoate Traditional Name: 2-sulfoxycaprylic acid 2-ethyldodecyl ester Formula: C22H44O6S MolecularWeight: 436.64616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC)COC(=O)C(CCCCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCC(CC)COC(=O)C(CCCCCC)OS(=O)(=O)O

InChI

InChI=1S/C22H44O6S/c1-4-7-9-11-12-13-14-15-17-20(6-3)19-27-22(23)21(28-29(24,25)26)18-16-10-8-5-2/h20-21H,4-19H2,1-3H3,(H,24,25,26)