4-but-1-en-2-yl-3-methylsulfonyl-benzoyl chloride

Systemtic Name: 4-but-1-en-2-yl-3-methylsulfonyl-benzoyl chloride Openeye Name: 4-(1-methylenepropyl)-3-methylsulfonyl-benzoyl chloride CAS Name: 4-but-1-en-2-yl-3-methylsulfonylbenzoyl chloride IUPAC Name: 4-but-1-en-2-yl-3-methylsulfonylbenzoyl chloride Traditional Name: 4-(1-ethylvinyl)-3-mesyl-benzoyl chloride Formula: C12H13ClO3S MolecularWeight: 272.74782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)C1=C(C=C(C=C1)C(=O)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(=C)C1=C(C=C(C=C1)C(=O)Cl)S(=O)(=O)C

InChI

InChI=1S/C12H13ClO3S/c1-4-8(2)10-6-5-9(12(13)14)7-11(10)17(3,15)16/h5-7H,2,4H2,1,3H3