(4-chloranyl-2-methyl-phenyl) 4-methyl-3-methylsulfonyl-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)C)S(=O)(=O)C

InChI

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