2-(4-methylsulfonylphenyl)pent-1-ene-1,4-dione

Systemtic Name: 2-(4-methylsulfonylphenyl)pent-1-ene-1,4-dione Openeye Name: 2-(4-methylsulfonylphenyl)pent-1-ene-1,4-dione CAS Name: 2-(4-methylsulfonylphenyl)-1-pentene-1,4-dione IUPAC Name: 2-(4-methylsulfonylphenyl)pent-1-ene-1,4-dione Traditional Name: 2-(4-mesylphenyl)pent-1-ene-1,4-dione Formula: C12H12O4S MolecularWeight: 252.28628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O4S/c1-9(14)7-11(8-13)10-3-5-12(6-4-10)17(2,15)16/h3-6H,7H2,1-2H3