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

Systemtic Name: 5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-4-(3-methylisoxazol-5-yl)cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-4-(3-methyl-5-isoxazolyl)cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-4-(3-methylisoxazol-5-yl)cyclohexane-1,3-quinone Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2C(=O)CC(=O)CC2(C)C

Isomeric SMILES

CC1=NOC(=C1)C2C(=O)CC(=O)CC2(C)C

InChI

InChI=1S/C12H15NO3/c1-7-4-10(16-13-7)11-9(15)5-8(14)6-12(11,2)3/h4,11H,5-6H2,1-3H3