6-heptylsulfanylhexyl hydrogen sulfate

Systemtic Name: 6-heptylsulfanylhexyl hydrogen sulfate Openeye Name: 6-heptylsulfanylhexyl hydrogen sulfate CAS Name: sulfuric acid 6-(heptylthio)hexyl ester IUPAC Name: 6-heptylsulfanylhexyl hydrogen sulfate Traditional Name: sulfuric acid 6-(heptylthio)hexyl ester Formula: C13H28O4S2 MolecularWeight: 312.48902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSCCCCCCOS(=O)(=O)O

Isomeric SMILES

CCCCCCCSCCCCCCOS(=O)(=O)O

InChI

InChI=1S/C13H28O4S2/c1-2-3-4-6-9-12-18-13-10-7-5-8-11-17-19(14,15)16/h2-13H2,1H3,(H,14,15,16)