4-tert-butylsulfinyl-2-methyl-5-methylsulfonyl-benzoyl chloride

Systemtic Name: 4-tert-butylsulfinyl-2-methyl-5-methylsulfonyl-benzoyl chloride Openeye Name: 4-tert-butylsulfinyl-2-methyl-5-methylsulfonyl-benzoyl chloride CAS Name: 4-tert-butylsulfinyl-2-methyl-5-methylsulfonylbenzoyl chloride IUPAC Name: 4-tert-butylsulfinyl-2-methyl-5-methylsulfonylbenzoyl chloride Traditional Name: 4-tert-butylsulfinyl-5-mesyl-2-methyl-benzoyl chloride Formula: C13H17ClO4S2 MolecularWeight: 336.85468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)S(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)S(=O)C(C)(C)C

InChI

InChI=1S/C13H17ClO4S2/c1-8-6-10(19(16)13(2,3)4)11(20(5,17)18)7-9(8)12(14)15/h6-7H,1-5H3