5-(3-methylphenyl)cyclohexane-1,3-dione

Systemtic Name: 5-(3-methylphenyl)cyclohexane-1,3-dione Openeye Name: 5-(m-tolyl)cyclohexane-1,3-dione CAS Name: 5-(3-methylphenyl)cyclohexane-1,3-dione IUPAC Name: 5-(3-methylphenyl)cyclohexane-1,3-dione Traditional Name: 5-(m-tolyl)cyclohexane-1,3-quinone Formula: C13H14O2 MolecularWeight: 202.24906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CC(=O)CC(=O)C2

Isomeric SMILES

CC1=CC=CC(=C1)C2CC(=O)CC(=O)C2

InChI

InChI=1S/C13H14O2/c1-9-3-2-4-10(5-9)11-6-12(14)8-13(15)7-11/h2-5,11H,6-8H2,1H3