2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethanoate

Systemtic Name: 2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethanoate Openeye Name: 2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)acetate CAS Name: 2-(1-ethyl-3,5-dimethyl-4-pyrazolyl)acetate IUPAC Name: 2-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetate Traditional Name: 2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)acetate Formula: C9H13N2O2- MolecularWeight: 181.21172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CC(=O)[O-])C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CC(=O)[O-])C

InChI

InChI=1S/C9H14N2O2/c1-4-11-7(3)8(5-9(12)13)6(2)10-11/h4-5H2,1-3H3,(H,12,13)/p-1