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

Systemtic Name: (2,2-dimethyl-3-oxidanylidene-1-benzofuran-7-yl) hydrogen sulfate Openeye Name: (2,2-dimethyl-3-oxo-benzofuran-7-yl) hydrogen sulfate CAS Name: sulfuric acid (2,2-dimethyl-3-oxo-7-benzofuranyl) ester IUPAC Name: (2,2-dimethyl-3-oxo-1-benzofuran-7-yl) hydrogen sulfate Traditional Name: sulfuric acid (3-keto-2,2-dimethyl-coumaran-7-yl) ester Formula: C10H10O6S MolecularWeight: 258.2478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10O6S/c1-10(2)9(11)6-4-3-5-7(8(6)15-10)16-17(12,13)14/h3-5H,1-2H3,(H,12,13,14)