(3,5-dimethylpyrazol-3-yl) butanoate

Systemtic Name: (3,5-dimethylpyrazol-3-yl) butanoate Openeye Name: (3,5-dimethylpyrazol-3-yl) butanoate CAS Name: butanoic acid (3,5-dimethyl-3-pyrazolyl) ester IUPAC Name: (3,5-dimethylpyrazol-3-yl) butanoate Traditional Name: butyric acid (3,5-dimethylpyrazol-3-yl) ester Formula: C9H14N2O2 MolecularWeight: 182.21966

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1(C=C(N=N1)C)C

Isomeric SMILES

CCCC(=O)OC1(C=C(N=N1)C)C

InChI

InChI=1S/C9H14N2O2/c1-4-5-8(12)13-9(3)6-7(2)10-11-9/h6H,4-5H2,1-3H3