(2,6-dimethylphenyl) 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: (2,6-dimethylphenyl) 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (2,6-dimethylphenyl) 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (2,6-dimethylphenyl) ester Formula: C16H15ClO4S MolecularWeight: 338.8059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C16H15ClO4S/c1-10-5-4-6-11(2)15(10)21-16(18)13-9-12(22(3,19)20)7-8-14(13)17/h4-9H,1-3H3