2,5,5-trimethyl-2-phenethyl-cyclohexane-1,3-dione

Systemtic Name: 2,5,5-trimethyl-2-phenethyl-cyclohexane-1,3-dione Openeye Name: 2,5,5-trimethyl-2-phenethyl-cyclohexane-1,3-dione CAS Name: 2,5,5-trimethyl-2-phenethylcyclohexane-1,3-dione IUPAC Name: 2,5,5-trimethyl-2-phenethylcyclohexane-1,3-dione Traditional Name: 2,5,5-trimethyl-2-phenethyl-cyclohexane-1,3-quinone Formula: C17H22O2 MolecularWeight: 258.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)(C)CCC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)(C)CCC2=CC=CC=C2)C

InChI

InChI=1S/C17H22O2/c1-16(2)11-14(18)17(3,15(19)12-16)10-9-13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3