(2-ethyl-3-oxidanyl-hexyl) hydrogen sulfate

Systemtic Name: (2-ethyl-3-oxidanyl-hexyl) hydrogen sulfate Openeye Name: (2-ethyl-3-hydroxy-hexyl) hydrogen sulfate CAS Name: sulfuric acid (2-ethyl-3-hydroxyhexyl) ester IUPAC Name: (2-ethyl-3-hydroxyhexyl) hydrogen sulfate Traditional Name: sulfuric acid (2-ethyl-3-hydroxy-hexyl) ester Formula: C8H18O5S MolecularWeight: 226.29052

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)COS(=O)(=O)O)O

Isomeric SMILES

CCCC(C(CC)COS(=O)(=O)O)O

InChI

InChI=1S/C8H18O5S/c1-3-5-8(9)7(4-2)6-13-14(10,11)12/h7-9H,3-6H2,1-2H3,(H,10,11,12)