(3,4-dimethylphenyl) 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: (3,4-dimethylphenyl) 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (3,4-dimethylphenyl) 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (3,4-dimethylphenyl) ester Formula: C16H15ClO4S MolecularWeight: 338.8059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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