3,3-dimethyl-1-(4-methylphenyl)sulfonyl-butan-2-one

Systemtic Name: 3,3-dimethyl-1-(4-methylphenyl)sulfonyl-butan-2-one Openeye Name: 3,3-dimethyl-1-(p-tolylsulfonyl)butan-2-one CAS Name: 3,3-dimethyl-1-(4-methylphenyl)sulfonyl-2-butanone IUPAC Name: 3,3-dimethyl-1-(4-methylphenyl)sulfonylbutan-2-one Traditional Name: 3,3-dimethyl-1-tosyl-butan-2-one Formula: C13H18O3S MolecularWeight: 254.34522

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)C

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3S/c1-10-5-7-11(8-6-10)17(15,16)9-12(14)13(2,3)4/h5-8H,9H2,1-4H3