2,2,4-trimethyl-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2,2,4-trimethyl-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2,2,4-trimethyl-5-phenyl-cyclohexane-1,3-dione CAS Name: 2,2,4-trimethyl-5-phenylcyclohexane-1,3-dione IUPAC Name: 2,2,4-trimethyl-5-phenylcyclohexane-1,3-dione Traditional Name: 2,2,4-trimethyl-5-phenyl-cyclohexane-1,3-quinone Formula: C15H18O2 MolecularWeight: 230.30222

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(=O)C(C1=O)(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1C(CC(=O)C(C1=O)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C15H18O2/c1-10-12(11-7-5-4-6-8-11)9-13(16)15(2,3)14(10)17/h4-8,10,12H,9H2,1-3H3