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

Systemtic Name: 3,3-dimethyl-1-(4-methylphenyl)butan-1-one Openeye Name: 3,3-dimethyl-1-(p-tolyl)butan-1-one CAS Name: 3,3-dimethyl-1-(4-methylphenyl)-1-butanone IUPAC Name: 3,3-dimethyl-1-(4-methylphenyl)butan-1-one Traditional Name: 3,3-dimethyl-1-(p-tolyl)butan-1-one Formula: C13H18O MolecularWeight: 190.28142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O/c1-10-5-7-11(8-6-10)12(14)9-13(2,3)4/h5-8H,9H2,1-4H3