2-methyl-5-methylsulfonyl-4-propan-2-ylsulfinyl-benzoyl chloride

Systemtic Name: 2-methyl-5-methylsulfonyl-4-propan-2-ylsulfinyl-benzoyl chloride Openeye Name: 4-isopropylsulfinyl-2-methyl-5-methylsulfonyl-benzoyl chloride CAS Name: 2-methyl-5-methylsulfonyl-4-propan-2-ylsulfinylbenzoyl chloride IUPAC Name: 2-methyl-5-methylsulfonyl-4-propan-2-ylsulfinylbenzoyl chloride Traditional Name: 4-isopropylsulfinyl-5-mesyl-2-methyl-benzoyl chloride Formula: C12H15ClO4S2 MolecularWeight: 322.8281

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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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClO4S2/c1-7(2)18(15)10-5-8(3)9(12(13)14)6-11(10)19(4,16)17/h5-7H,1-4H3