5,5-dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[2-oxo-2-(p-tolyl)ethyl]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[2-(4-methylphenyl)-2-oxoethyl]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[2-(4-methylphenyl)-2-oxoethyl]cyclohexane-1,3-dione Traditional Name: 2-[2-keto-2-(p-tolyl)ethyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC2C(=O)CC(CC2=O)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC2C(=O)CC(CC2=O)(C)C

InChI

InChI=1S/C17H20O3/c1-11-4-6-12(7-5-11)14(18)8-13-15(19)9-17(2,3)10-16(13)20/h4-7,13H,8-10H2,1-3H3