(2,5-diethoxy-4-sulfooxy-phenyl) hydrogen sulfate

Systemtic Name: (2,5-diethoxy-4-sulfooxy-phenyl) hydrogen sulfate Openeye Name: (2,5-diethoxy-4-sulfooxy-phenyl) hydrogen sulfate CAS Name: sulfuric acid (2,5-diethoxy-4-sulfooxyphenyl) ester IUPAC Name: (2,5-diethoxy-4-sulfooxyphenyl) hydrogen sulfate Traditional Name: sulfuric acid (2,5-diethoxy-4-sulfoxy-phenyl) ester Formula: C10H14O10S2 MolecularWeight: 358.34216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1OS(=O)(=O)O)OCC)OS(=O)(=O)O

Isomeric SMILES

CCOC1=CC(=C(C=C1OS(=O)(=O)O)OCC)OS(=O)(=O)O

InChI

InChI=1S/C10H14O10S2/c1-3-17-7-5-10(20-22(14,15)16)8(18-4-2)6-9(7)19-21(11,12)13/h5-6H,3-4H2,1-2H3,(H,11,12,13)(H,14,15,16)