(2-butan-2-ylphenyl) 3-methylsulfonylbenzenesulfonate

Systemtic Name: (2-butan-2-ylphenyl) 3-methylsulfonylbenzenesulfonate Openeye Name: (2-sec-butylphenyl) 3-methylsulfonylbenzenesulfonate CAS Name: 3-methylsulfonylbenzenesulfonic acid (2-butan-2-ylphenyl) ester IUPAC Name: (2-butan-2-ylphenyl) 3-methylsulfonylbenzenesulfonate Traditional Name: 3-mesylbenzenesulfonic acid (2-sec-butylphenyl) ester Formula: C17H20O5S2 MolecularWeight: 368.4677

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C

Isomeric SMILES

CCC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C

InChI

InChI=1S/C17H20O5S2/c1-4-13(2)16-10-5-6-11-17(16)22-24(20,21)15-9-7-8-14(12-15)23(3,18)19/h5-13H,4H2,1-3H3