1-(4-methylphenyl)heptane-1,2-dione

Systemtic Name: 1-(4-methylphenyl)heptane-1,2-dione Openeye Name: 1-(p-tolyl)heptane-1,2-dione CAS Name: 1-(4-methylphenyl)heptane-1,2-dione IUPAC Name: 1-(4-methylphenyl)heptane-1,2-dione Traditional Name: 1-(p-tolyl)heptane-1,2-dione Formula: C14H18O2 MolecularWeight: 218.29152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCC(=O)C(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H18O2/c1-3-4-5-6-13(15)14(16)12-9-7-11(2)8-10-12/h7-10H,3-6H2,1-2H3