2-ethyl-4-ethylsulfonyl-5-methylsulfonyl-benzoyl chloride

Systemtic Name: 2-ethyl-4-ethylsulfonyl-5-methylsulfonyl-benzoyl chloride Openeye Name: 2-ethyl-4-ethylsulfonyl-5-methylsulfonyl-benzoyl chloride CAS Name: 2-ethyl-4-ethylsulfonyl-5-methylsulfonylbenzoyl chloride IUPAC Name: 2-ethyl-4-ethylsulfonyl-5-methylsulfonylbenzoyl chloride Traditional Name: 4-esyl-2-ethyl-5-mesyl-benzoyl chloride Formula: C12H15ClO5S2 MolecularWeight: 338.8275

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)S(=O)(=O)CC

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)S(=O)(=O)CC

InChI

InChI=1S/C12H15ClO5S2/c1-4-8-6-11(20(17,18)5-2)10(19(3,15)16)7-9(8)12(13)14/h6-7H,4-5H2,1-3H3