5-methyl-1-(4-methylphenyl)hexan-2-one

Systemtic Name: 5-methyl-1-(4-methylphenyl)hexan-2-one Openeye Name: 5-methyl-1-(p-tolyl)hexan-2-one CAS Name: 5-methyl-1-(4-methylphenyl)-2-hexanone IUPAC Name: 5-methyl-1-(4-methylphenyl)hexan-2-one Traditional Name: 5-methyl-1-(p-tolyl)hexan-2-one Formula: C14H20O MolecularWeight: 204.308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O/c1-11(2)4-9-14(15)10-13-7-5-12(3)6-8-13/h5-8,11H,4,9-10H2,1-3H3