(2,4,6-trimethylphenyl) 4-methyl-3-methylsulfonyl-benzoate

Systemtic Name: (2,4,6-trimethylphenyl) 4-methyl-3-methylsulfonyl-benzoate Openeye Name: (2,4,6-trimethylphenyl) 4-methyl-3-methylsulfonyl-benzoate CAS Name: 4-methyl-3-methylsulfonylbenzoic acid (2,4,6-trimethylphenyl) ester IUPAC Name: (2,4,6-trimethylphenyl) 4-methyl-3-methylsulfonylbenzoate Traditional Name: 3-mesyl-4-methyl-benzoic acid mesityl ester Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2C)C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2C)C)C)S(=O)(=O)C

InChI

InChI=1S/C18H20O4S/c1-11-8-13(3)17(14(4)9-11)22-18(19)15-7-6-12(2)16(10-15)23(5,20)21/h6-10H,1-5H3