(2,2-dimethyl-3H-1-benzofuran-7-yl) 4-methylsulfonylbenzenesulfonate

Systemtic Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 4-methylsulfonylbenzenesulfonate Openeye Name: (2,2-dimethyl-3H-benzofuran-7-yl) 4-methylsulfonylbenzenesulfonate CAS Name: 4-methylsulfonylbenzenesulfonic acid (2,2-dimethyl-3H-benzofuran-7-yl) ester IUPAC Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 4-methylsulfonylbenzenesulfonate Traditional Name: 4-mesylbenzenesulfonic acid (2,2-dimethylcoumaran-7-yl) ester Formula: C17H18O6S2 MolecularWeight: 382.45122

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C17H18O6S2/c1-17(2)11-12-5-4-6-15(16(12)22-17)23-25(20,21)14-9-7-13(8-10-14)24(3,18)19/h4-10H,11H2,1-3H3