1-sulfooxynon-8-en-3-yl hydrogen sulfate

Systemtic Name: 1-sulfooxynon-8-en-3-yl hydrogen sulfate Openeye Name: 1-(2-sulfooxyethyl)hept-6-enyl hydrogen sulfate CAS Name: sulfuric acid 1-sulfooxynon-8-en-3-yl ester IUPAC Name: 1-sulfooxynon-8-en-3-yl hydrogen sulfate Traditional Name: sulfuric acid 1-(2-sulfoxyethyl)hept-6-enyl ester Formula: C9H18O8S2 MolecularWeight: 318.36442

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCC(CCOS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

C=CCCCCC(CCOS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C9H18O8S2/c1-2-3-4-5-6-9(17-19(13,14)15)7-8-16-18(10,11)12/h2,9H,1,3-8H2,(H,10,11,12)(H,13,14,15)