5-(hydroxymethyl)heptylsulfanyl sulfate

Systemtic Name: 5-(hydroxymethyl)heptylsulfanyl sulfate Openeye Name: 5-(hydroxymethyl)heptylsulfanyl sulfate CAS Name: [5-(hydroxymethyl)heptylthio] sulfate IUPAC Name: 5-(hydroxymethyl)heptylsulfanyl sulfate Traditional Name: (5-methylolheptylthio) sulfate Formula: C8H17O5S2- MolecularWeight: 257.34758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCSOS(=O)(=O)[O-])CO

Isomeric SMILES

CCC(CCCCSOS(=O)(=O)[O-])CO

InChI

InChI=1S/C8H18O5S2/c1-2-8(7-9)5-3-4-6-14-13-15(10,11)12/h8-9H,2-7H2,1H3,(H,10,11,12)/p-1