12-fluoranyldodecyl 2-sulfooxyoctanoate

Systemtic Name: 12-fluoranyldodecyl 2-sulfooxyoctanoate Openeye Name: 12-fluorododecyl 2-sulfooxyoctanoate CAS Name: 2-sulfooxyoctanoic acid 12-fluorododecyl ester IUPAC Name: 12-fluorododecyl 2-sulfooxyoctanoate Traditional Name: 2-sulfoxycaprylic acid 12-fluorododecyl ester Formula: C20H39FO6S MolecularWeight: 426.583463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OCCCCCCCCCCCCF)OS(=O)(=O)O

Isomeric SMILES

CCCCCCC(C(=O)OCCCCCCCCCCCCF)OS(=O)(=O)O

InChI

InChI=1S/C20H39FO6S/c1-2-3-4-13-16-19(27-28(23,24)25)20(22)26-18-15-12-10-8-6-5-7-9-11-14-17-21/h19H,2-18H2,1H3,(H,23,24,25)