1-[4-ethanoyl-3,5-bis(oxidanyl)phenoxy]propane-1-sulfonic acid

Systemtic Name: 1-[4-ethanoyl-3,5-bis(oxidanyl)phenoxy]propane-1-sulfonic acid Openeye Name: 1-(4-acetyl-3,5-dihydroxy-phenoxy)propane-1-sulfonic acid CAS Name: 1-(4-acetyl-3,5-dihydroxyphenoxy)-1-propanesulfonic acid IUPAC Name: 1-(4-acetyl-3,5-dihydroxyphenoxy)propane-1-sulfonic acid Traditional Name: 1-(4-acetyl-3,5-dihydroxy-phenoxy)propane-1-sulfonic acid Formula: C11H14O7S MolecularWeight: 290.28966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC1=CC(=C(C(=C1)O)C(=O)C)O)S(=O)(=O)O

Isomeric SMILES

CCC(OC1=CC(=C(C(=C1)O)C(=O)C)O)S(=O)(=O)O

InChI

InChI=1S/C11H14O7S/c1-3-10(19(15,16)17)18-7-4-8(13)11(6(2)12)9(14)5-7/h4-5,10,13-14H,3H2,1-2H3,(H,15,16,17)