4-[(E)-but-1-enyl]-2-methyl-5-methylsulfonyl-benzoyl chloride

Systemtic Name: 4-[(E)-but-1-enyl]-2-methyl-5-methylsulfonyl-benzoyl chloride Openeye Name: 4-[(E)-but-1-enyl]-2-methyl-5-methylsulfonyl-benzoyl chloride CAS Name: 4-[(E)-but-1-enyl]-2-methyl-5-methylsulfonylbenzoyl chloride IUPAC Name: 4-[(E)-but-1-enyl]-2-methyl-5-methylsulfonylbenzoyl chloride Traditional Name: 4-[(E)-but-1-enyl]-5-mesyl-2-methyl-benzoyl chloride Formula: C13H15ClO3S MolecularWeight: 286.7744

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1=CC(=C(C=C1S(=O)(=O)C)C(=O)Cl)C

Isomeric SMILES

CC/C=C/C1=CC(=C(C=C1S(=O)(=O)C)C(=O)Cl)C

InChI

InChI=1S/C13H15ClO3S/c1-4-5-6-10-7-9(2)11(13(14)15)8-12(10)18(3,16)17/h5-8H,4H2,1-3H3/b6-5+