(4-methylsulfonyloxy-3-phenyl-butyl) methanesulfonate

Systemtic Name: (4-methylsulfonyloxy-3-phenyl-butyl) methanesulfonate Openeye Name: (4-methylsulfonyloxy-3-phenyl-butyl) methanesulfonate CAS Name: methanesulfonic acid (4-methylsulfonyloxy-3-phenylbutyl) ester IUPAC Name: (4-methylsulfonyloxy-3-phenylbutyl) methanesulfonate Traditional Name: methanesulfonic acid (4-methylsulfonyloxy-3-phenyl-butyl) ester Formula: C12H18O6S2 MolecularWeight: 322.39772

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC(COS(=O)(=O)C)C1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)OCCC(COS(=O)(=O)C)C1=CC=CC=C1

InChI

InChI=1S/C12H18O6S2/c1-19(13,14)17-9-8-12(10-18-20(2,15)16)11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3