2,5,5-trimethyl-2-(phenylmethyl)cyclohexane-1,3-dione

Systemtic Name: 2,5,5-trimethyl-2-(phenylmethyl)cyclohexane-1,3-dione Openeye Name: 2-benzyl-2,5,5-trimethyl-cyclohexane-1,3-dione CAS Name: 2,5,5-trimethyl-2-(phenylmethyl)cyclohexane-1,3-dione IUPAC Name: 2-benzyl-2,5,5-trimethylcyclohexane-1,3-dione Traditional Name: 2-benzyl-2,5,5-trimethyl-cyclohexane-1,3-quinone Formula: C16H20O2 MolecularWeight: 244.3288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20O2/c1-15(2)10-13(17)16(3,14(18)11-15)9-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3