(2,2-dimethyl-3-oxidanyl-3H-1-benzofuran-7-yl) hydrogen sulfate

Systemtic Name: (2,2-dimethyl-3-oxidanyl-3H-1-benzofuran-7-yl) hydrogen sulfate Openeye Name: (3-hydroxy-2,2-dimethyl-3H-benzofuran-7-yl) hydrogen sulfate CAS Name: sulfuric acid (3-hydroxy-2,2-dimethyl-3H-benzofuran-7-yl) ester IUPAC Name: (3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) hydrogen sulfate Traditional Name: sulfuric acid (3-hydroxy-2,2-dimethyl-coumaran-7-yl) ester Formula: C10H12O6S MolecularWeight: 260.26368

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=C(O1)C(=CC=C2)OS(=O)(=O)O)O)C

Isomeric SMILES

CC1(C(C2=C(O1)C(=CC=C2)OS(=O)(=O)O)O)C

InChI

InChI=1S/C10H12O6S/c1-10(2)9(11)6-4-3-5-7(8(6)15-10)16-17(12,13)14/h3-5,9,11H,1-2H3,(H,12,13,14)