3-methyl-1-(4-methylphenyl)sulfonyl-butan-2-one

Systemtic Name: 3-methyl-1-(4-methylphenyl)sulfonyl-butan-2-one Openeye Name: 3-methyl-1-(p-tolylsulfonyl)butan-2-one CAS Name: 3-methyl-1-(4-methylphenyl)sulfonyl-2-butanone IUPAC Name: 3-methyl-1-(4-methylphenyl)sulfonylbutan-2-one Traditional Name: 3-methyl-1-tosyl-butan-2-one Formula: C12H16O3S MolecularWeight: 240.31864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)C(C)C

InChI

InChI=1S/C12H16O3S/c1-9(2)12(13)8-16(14,15)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3