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

Systemtic Name: 2-ethyl-5-methylsulfonyl-4-pentylsulfinyl-benzoyl chloride Openeye Name: 2-ethyl-5-methylsulfonyl-4-pentylsulfinyl-benzoyl chloride CAS Name: 2-ethyl-5-methylsulfonyl-4-pentylsulfinylbenzoyl chloride IUPAC Name: 2-ethyl-5-methylsulfonyl-4-pentylsulfinylbenzoyl chloride Traditional Name: 4-amylsulfinyl-2-ethyl-5-mesyl-benzoyl chloride Formula: C15H21ClO4S2 MolecularWeight: 364.90784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)C1=C(C=C(C(=C1)CC)C(=O)Cl)S(=O)(=O)C

Isomeric SMILES

CCCCCS(=O)C1=C(C=C(C(=C1)CC)C(=O)Cl)S(=O)(=O)C

InChI

InChI=1S/C15H21ClO4S2/c1-4-6-7-8-21(18)13-9-11(5-2)12(15(16)17)10-14(13)22(3,19)20/h9-10H,4-8H2,1-3H3