2-ethyl-5-methylsulfonyl-4-(phenylsulfinyl)benzoyl chloride

Systemtic Name: 2-ethyl-5-methylsulfonyl-4-(phenylsulfinyl)benzoyl chloride Openeye Name: 4-(benzenesulfinyl)-2-ethyl-5-methylsulfonyl-benzoyl chloride CAS Name: 4-(benzenesulfinyl)-2-ethyl-5-methylsulfonylbenzoyl chloride IUPAC Name: 4-(benzenesulfinyl)-2-ethyl-5-methylsulfonylbenzoyl chloride Traditional Name: 4-(benzenesulfinyl)-2-ethyl-5-mesyl-benzoyl chloride Formula: C16H15ClO4S2 MolecularWeight: 370.8709

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)S(=O)C2=CC=CC=C2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)S(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H15ClO4S2/c1-3-11-9-14(22(19)12-7-5-4-6-8-12)15(23(2,20)21)10-13(11)16(17)18/h4-10H,3H2,1-2H3