[1-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanyl-ethyl] hydrogen sulfate

Systemtic Name: [1-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanyl-ethyl] hydrogen sulfate Openeye Name: [2-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)ethyl] hydrogen sulfate CAS Name: sulfuric acid [2-hydroxy-1-(4-hydroxy-3-methoxyphenyl)ethyl] ester IUPAC Name: [2-hydroxy-1-(4-hydroxy-3-methoxyphenyl)ethyl] hydrogen sulfate Traditional Name: sulfuric acid [2-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)ethyl] ester Formula: C9H12O7S MolecularWeight: 264.25238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12O7S/c1-15-8-4-6(2-3-7(8)11)9(5-10)16-17(12,13)14/h2-4,9-11H,5H2,1H3,(H,12,13,14)