[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C19H20O5S MolecularWeight: 360.4241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C)C

InChI

InChI=1S/C19H20O5S/c1-12-8-14(3)17(9-13(12)2)18(20)11-24-19(21)15-6-5-7-16(10-15)25(4,22)23/h5-10H,11H2,1-4H3