(E)-4-(2-chlorophenyl)-3-methylsulfonyl-but-3-en-2-one

Systemtic Name: (E)-4-(2-chlorophenyl)-3-methylsulfonyl-but-3-en-2-one Openeye Name: (E)-4-(2-chlorophenyl)-3-methylsulfonyl-but-3-en-2-one CAS Name: (E)-4-(2-chlorophenyl)-3-methylsulfonyl-3-buten-2-one IUPAC Name: (E)-4-(2-chlorophenyl)-3-methylsulfonylbut-3-en-2-one Traditional Name: (E)-4-(2-chlorophenyl)-3-mesyl-but-3-en-2-one Formula: C11H11ClO3S MolecularWeight: 258.72124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC=C1Cl)S(=O)(=O)C

Isomeric SMILES

CC(=O)/C(=C\C1=CC=CC=C1Cl)/S(=O)(=O)C

InChI

InChI=1S/C11H11ClO3S/c1-8(13)11(16(2,14)15)7-9-5-3-4-6-10(9)12/h3-7H,1-2H3/b11-7+