2-ethanoyl-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-ethanoyl-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-acetyl-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-acetyl-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-acetyl-5-phenylcyclohexane-1,3-dione Traditional Name: 2-acetyl-5-phenyl-cyclohexane-1,3-quinone Formula: C14H14O3 MolecularWeight: 230.25916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)CC(CC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1C(=O)CC(CC1=O)C2=CC=CC=C2

InChI

InChI=1S/C14H14O3/c1-9(15)14-12(16)7-11(8-13(14)17)10-5-3-2-4-6-10/h2-6,11,14H,7-8H2,1H3