1-(3,5-dimethylpyrazol-1-yl)-2-ethyl-hexane-1,3-dione

Systemtic Name: 1-(3,5-dimethylpyrazol-1-yl)-2-ethyl-hexane-1,3-dione Openeye Name: 1-(3,5-dimethylpyrazol-1-yl)-2-ethyl-hexane-1,3-dione CAS Name: 1-(3,5-dimethyl-1-pyrazolyl)-2-ethylhexane-1,3-dione IUPAC Name: 1-(3,5-dimethylpyrazol-1-yl)-2-ethylhexane-1,3-dione Traditional Name: 1-(3,5-dimethylpyrazol-1-yl)-2-ethyl-hexane-1,3-dione Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CC)C(=O)N1C(=CC(=N1)C)C

Isomeric SMILES

CCCC(=O)C(CC)C(=O)N1C(=CC(=N1)C)C

InChI

InChI=1S/C13H20N2O2/c1-5-7-12(16)11(6-2)13(17)15-10(4)8-9(3)14-15/h8,11H,5-7H2,1-4H3