(1-oxidanyl-1-phenoxy-propyl) 2-methylsulfonylbenzenesulfonate

Systemtic Name: (1-oxidanyl-1-phenoxy-propyl) 2-methylsulfonylbenzenesulfonate Openeye Name: (1-hydroxy-1-phenoxy-propyl) 2-methylsulfonylbenzenesulfonate CAS Name: 2-methylsulfonylbenzenesulfonic acid (1-hydroxy-1-phenoxypropyl) ester IUPAC Name: (1-hydroxy-1-phenoxypropyl) 2-methylsulfonylbenzenesulfonate Traditional Name: 2-mesylbenzenesulfonic acid (1-hydroxy-1-phenoxy-propyl) ester Formula: C16H18O7S2 MolecularWeight: 386.43992

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Descriptors Computed from Structure

Canonical SMILES:

CCC(O)(OC1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CCC(O)(OC1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C16H18O7S2/c1-3-16(17,22-13-9-5-4-6-10-13)23-25(20,21)15-12-8-7-11-14(15)24(2,18)19/h4-12,17H,3H2,1-2H3