(5-ethanoyl-2-methoxy-4-oxidanyl-phenyl) hydrogen sulfate

Systemtic Name: (5-ethanoyl-2-methoxy-4-oxidanyl-phenyl) hydrogen sulfate Openeye Name: (5-acetyl-4-hydroxy-2-methoxy-phenyl) hydrogen sulfate CAS Name: sulfuric acid (5-acetyl-4-hydroxy-2-methoxyphenyl) ester IUPAC Name: (5-acetyl-4-hydroxy-2-methoxyphenyl) hydrogen sulfate Traditional Name: sulfuric acid (5-acetyl-4-hydroxy-2-methoxy-phenyl) ester Formula: C9H10O7S MolecularWeight: 262.2365

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1O)OC)OS(=O)(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1O)OC)OS(=O)(=O)O

InChI

InChI=1S/C9H10O7S/c1-5(10)6-3-9(16-17(12,13)14)8(15-2)4-7(6)11/h3-4,11H,1-2H3,(H,12,13,14)