5,5-dimethyl-2-(2-phenylethanoyl)cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-(2-phenylethanoyl)cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-(2-phenylacetyl)cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-(1-oxo-2-phenylethyl)cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-(2-phenylacetyl)cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-(2-phenylacetyl)cyclohexane-1,3-quinone Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(=O)CC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C16H18O3/c1-16(2)9-13(18)15(14(19)10-16)12(17)8-11-6-4-3-5-7-11/h3-7,15H,8-10H2,1-2H3