[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl] 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl] 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid (2-keto-2-mesityl-ethyl) ester Formula: C19H19ClO5S MolecularWeight: 394.86916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClO5S/c1-11-7-12(2)18(13(3)8-11)16(21)10-25-19(22)14-5-6-15(20)17(9-14)26(4,23)24/h5-9H,10H2,1-4H3