(1-decoxy-3-oxidanyl-propan-2-yl) hydrogen sulfate

Systemtic Name: (1-decoxy-3-oxidanyl-propan-2-yl) hydrogen sulfate Openeye Name: [1-(decoxymethyl)-2-hydroxy-ethyl] hydrogen sulfate CAS Name: sulfuric acid (1-decoxy-3-hydroxypropan-2-yl) ester IUPAC Name: (1-decoxy-3-hydroxypropan-2-yl) hydrogen sulfate Traditional Name: sulfuric acid [1-(decoxymethyl)-2-hydroxy-ethyl] ester Formula: C13H28O6S MolecularWeight: 312.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOCC(CO)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCOCC(CO)OS(=O)(=O)O

InChI

InChI=1S/C13H28O6S/c1-2-3-4-5-6-7-8-9-10-18-12-13(11-14)19-20(15,16)17/h13-14H,2-12H2,1H3,(H,15,16,17)