(4-ethanoylphenyl) 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: (4-ethanoylphenyl) 2-methyl-5-methylsulfonyl-benzoate Openeye Name: (4-acetylphenyl) 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid (4-acetylphenyl) ester Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16O5S/c1-11-4-9-15(23(3,20)21)10-16(11)17(19)22-14-7-5-13(6-8-14)12(2)18/h4-10H,1-3H3