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

Systemtic Name: (3,3-dimethyl-5-methylsulfonyloxy-2H-1-benzofuran-2-yl) benzoate Openeye Name: (3,3-dimethyl-5-methylsulfonyloxy-2H-benzofuran-2-yl) benzoate CAS Name: benzoic acid (3,3-dimethyl-5-methylsulfonyloxy-2H-benzofuran-2-yl) ester IUPAC Name: (3,3-dimethyl-5-methylsulfonyloxy-2H-1-benzofuran-2-yl) benzoate Traditional Name: benzoic acid (3,3-dimethyl-5-methylsulfonyloxy-coumaran-2-yl) ester Formula: C18H18O6S MolecularWeight: 362.39692

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=C1C=C(C=C2)OS(=O)(=O)C)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C(OC2=C1C=C(C=C2)OS(=O)(=O)C)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H18O6S/c1-18(2)14-11-13(24-25(3,20)21)9-10-15(14)22-17(18)23-16(19)12-7-5-4-6-8-12/h4-11,17H,1-3H3