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

Systemtic Name: 2-methyl-5-methylsulfonyl-4-[(E)-prop-1-enyl]benzoyl chloride Openeye Name: 2-methyl-5-methylsulfonyl-4-[(E)-prop-1-enyl]benzoyl chloride CAS Name: 2-methyl-5-methylsulfonyl-4-[(E)-prop-1-enyl]benzoyl chloride IUPAC Name: 2-methyl-5-methylsulfonyl-4-[(E)-prop-1-enyl]benzoyl chloride Traditional Name: 5-mesyl-2-methyl-4-[(E)-prop-1-enyl]benzoyl chloride Formula: C12H13ClO3S MolecularWeight: 272.74782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClO3S/c1-4-5-9-6-8(2)10(12(13)14)7-11(9)17(3,15)16/h4-7H,1-3H3/b5-4+