4-sulfooxytridecan-5-yl hydrogen sulfate

Systemtic Name: 4-sulfooxytridecan-5-yl hydrogen sulfate Openeye Name: (1-propyl-2-sulfooxy-decyl) hydrogen sulfate CAS Name: sulfuric acid 4-sulfooxytridecan-5-yl ester IUPAC Name: 4-sulfooxytridecan-5-yl hydrogen sulfate Traditional Name: sulfuric acid (1-propyl-2-sulfoxy-decyl) ester Formula: C13H28O8S2 MolecularWeight: 376.48662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCC)OS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCC(C(CCC)OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C13H28O8S2/c1-3-5-6-7-8-9-11-13(21-23(17,18)19)12(10-4-2)20-22(14,15)16/h12-13H,3-11H2,1-2H3,(H,14,15,16)(H,17,18,19)