(3-methyl-5-oxidanyl-phenyl) hydrogen sulfate

Systemtic Name: (3-methyl-5-oxidanyl-phenyl) hydrogen sulfate Openeye Name: (3-hydroxy-5-methyl-phenyl) hydrogen sulfate CAS Name: sulfuric acid (3-hydroxy-5-methylphenyl) ester IUPAC Name: (3-hydroxy-5-methylphenyl) hydrogen sulfate Traditional Name: sulfuric acid (3-hydroxy-5-methyl-phenyl) ester Formula: C7H8O5S MolecularWeight: 204.20042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OS(=O)(=O)O)O

Isomeric SMILES

CC1=CC(=CC(=C1)OS(=O)(=O)O)O

InChI

InChI=1S/C7H8O5S/c1-5-2-6(8)4-7(3-5)12-13(9,10)11/h2-4,8H,1H3,(H,9,10,11)