11-sulfooxyicosan-10-yl hydrogen sulfate

Systemtic Name: 11-sulfooxyicosan-10-yl hydrogen sulfate Openeye Name: (1-nonyl-2-sulfooxy-undecyl) hydrogen sulfate CAS Name: sulfuric acid 11-sulfooxyeicosan-10-yl ester IUPAC Name: 11-sulfooxyicosan-10-yl hydrogen sulfate Traditional Name: sulfuric acid (1-nonyl-2-sulfoxy-undecyl) ester Formula: C20H42O8S2 MolecularWeight: 474.67268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(CCCCCCCCC)OS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC(C(CCCCCCCCC)OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C20H42O8S2/c1-3-5-7-9-11-13-15-17-19(27-29(21,22)23)20(28-30(24,25)26)18-16-14-12-10-8-6-4-2/h19-20H,3-18H2,1-2H3,(H,21,22,23)(H,24,25,26)