2-sulfooxyhexanoic acid

Systemtic Name: 2-sulfooxyhexanoic acid Openeye Name: 2-sulfooxyhexanoic acid CAS Name: 2-sulfooxyhexanoic acid IUPAC Name: 2-sulfooxyhexanoic acid Traditional Name: 2-sulfoxyhexanoic acid Formula: C6H12O6S MolecularWeight: 212.22088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)OS(=O)(=O)O

Isomeric SMILES

CCCCC(C(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C6H12O6S/c1-2-3-4-5(6(7)8)12-13(9,10)11/h5H,2-4H2,1H3,(H,7,8)(H,9,10,11)