(2-ethanoyl-5-oxidanyl-phenyl) hydrogen sulfate

Systemtic Name: (2-ethanoyl-5-oxidanyl-phenyl) hydrogen sulfate Openeye Name: (2-acetyl-5-hydroxy-phenyl) hydrogen sulfate CAS Name: sulfuric acid (2-acetyl-5-hydroxyphenyl) ester IUPAC Name: (2-acetyl-5-hydroxyphenyl) hydrogen sulfate Traditional Name: sulfuric acid (2-acetyl-5-hydroxy-phenyl) ester Formula: C8H8O6S MolecularWeight: 232.21052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)O)OS(=O)(=O)O

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)O)OS(=O)(=O)O

InChI

InChI=1S/C8H8O6S/c1-5(9)7-3-2-6(10)4-8(7)14-15(11,12)13/h2-4,10H,1H3,(H,11,12,13)