1-(2,5-dimethylphenyl)octane-1,3-dione

Systemtic Name: 1-(2,5-dimethylphenyl)octane-1,3-dione Openeye Name: 1-(2,5-dimethylphenyl)octane-1,3-dione CAS Name: 1-(2,5-dimethylphenyl)octane-1,3-dione IUPAC Name: 1-(2,5-dimethylphenyl)octane-1,3-dione Traditional Name: 1-(2,5-dimethylphenyl)octane-1,3-dione Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O2/c1-4-5-6-7-14(17)11-16(18)15-10-12(2)8-9-13(15)3/h8-10H,4-7,11H2,1-3H3