(3-methoxy-4-methylsulfonyloxy-phenyl) propane-1-sulfonate

Systemtic Name: (3-methoxy-4-methylsulfonyloxy-phenyl) propane-1-sulfonate Openeye Name: (3-methoxy-4-methylsulfonyloxy-phenyl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (3-methoxy-4-methylsulfonyloxyphenyl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (3-methoxy-4-methylsulfonyloxy-phenyl) ester Formula: C11H16O7S2 MolecularWeight: 324.37054

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)OC1=CC(=C(C=C1)OS(=O)(=O)C)OC

Isomeric SMILES

CCCS(=O)(=O)OC1=CC(=C(C=C1)OS(=O)(=O)C)OC

InChI

InChI=1S/C11H16O7S2/c1-4-7-20(14,15)17-9-5-6-10(11(8-9)16-2)18-19(3,12)13/h5-6,8H,4,7H2,1-3H3