5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)-2-propanoyl-cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)-2-propanoyl-cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-4-(3-methylisoxazol-5-yl)-2-propanoyl-cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-4-(3-methyl-5-isoxazolyl)-2-(1-oxopropyl)cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)-2-propanoylcyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-4-(3-methylisoxazol-5-yl)-2-propionyl-cyclohexane-1,3-quinone Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C(=O)CC(C(C1=O)C2=CC(=NO2)C)(C)C

Isomeric SMILES

CCC(=O)C1C(=O)CC(C(C1=O)C2=CC(=NO2)C)(C)C

InChI

InChI=1S/C15H19NO4/c1-5-9(17)12-10(18)7-15(3,4)13(14(12)19)11-6-8(2)16-20-11/h6,12-13H,5,7H2,1-4H3