(2-methoxy-4-sulfooxy-phenyl) hydrogen sulfate

Systemtic Name: (2-methoxy-4-sulfooxy-phenyl) hydrogen sulfate Openeye Name: (2-methoxy-4-sulfooxy-phenyl) hydrogen sulfate CAS Name: sulfuric acid (2-methoxy-4-sulfooxyphenyl) ester IUPAC Name: (2-methoxy-4-sulfooxyphenyl) hydrogen sulfate Traditional Name: sulfuric acid (2-methoxy-4-sulfoxy-phenyl) ester Formula: C7H8O9S2 MolecularWeight: 300.26302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C7H8O9S2/c1-14-7-4-5(15-17(8,9)10)2-3-6(7)16-18(11,12)13/h2-4H,1H3,(H,8,9,10)(H,11,12,13)