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

Systemtic Name: 4-tert-butylsulfinyl-2-ethyl-5-methylsulfonyl-benzoyl chloride Openeye Name: 4-tert-butylsulfinyl-2-ethyl-5-methylsulfonyl-benzoyl chloride CAS Name: 4-tert-butylsulfinyl-2-ethyl-5-methylsulfonylbenzoyl chloride IUPAC Name: 4-tert-butylsulfinyl-2-ethyl-5-methylsulfonylbenzoyl chloride Traditional Name: 4-tert-butylsulfinyl-2-ethyl-5-mesyl-benzoyl chloride Formula: C14H19ClO4S2 MolecularWeight: 350.88126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClO4S2/c1-6-9-7-11(20(17)14(2,3)4)12(21(5,18)19)8-10(9)13(15)16/h7-8H,6H2,1-5H3