(2-propan-2-ylphenyl) 2-chloranyl-5-methylsulfonyl-benzenesulfonate

Systemtic Name: (2-propan-2-ylphenyl) 2-chloranyl-5-methylsulfonyl-benzenesulfonate Openeye Name: (2-isopropylphenyl) 2-chloro-5-methylsulfonyl-benzenesulfonate CAS Name: 2-chloro-5-methylsulfonylbenzenesulfonic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 2-chloro-5-methylsulfonylbenzenesulfonate Traditional Name: 2-chloro-5-mesyl-benzenesulfonic acid o-cumenyl ester Formula: C16H17ClO5S2 MolecularWeight: 388.88618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClO5S2/c1-11(2)13-6-4-5-7-15(13)22-24(20,21)16-10-12(23(3,18)19)8-9-14(16)17/h4-11H,1-3H3