(3,3-dimethyl-5-methylsulfonyloxy-2H-1-benzofuran-2-yl) ethanoate

Systemtic Name: (3,3-dimethyl-5-methylsulfonyloxy-2H-1-benzofuran-2-yl) ethanoate Openeye Name: (3,3-dimethyl-5-methylsulfonyloxy-2H-benzofuran-2-yl) acetate CAS Name: acetic acid (3,3-dimethyl-5-methylsulfonyloxy-2H-benzofuran-2-yl) ester IUPAC Name: (3,3-dimethyl-5-methylsulfonyloxy-2H-1-benzofuran-2-yl) acetate Traditional Name: acetic acid (3,3-dimethyl-5-methylsulfonyloxy-coumaran-2-yl) ester Formula: C13H16O6S MolecularWeight: 300.32754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C

Isomeric SMILES

CC(=O)OC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C

InChI

InChI=1S/C13H16O6S/c1-8(14)17-12-13(2,3)10-7-9(19-20(4,15)16)5-6-11(10)18-12/h5-7,12H,1-4H3