2-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]ethanoate

Systemtic Name: 2-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]ethanoate Openeye Name: 2-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]acetate CAS Name: 2-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]acetate IUPAC Name: 2-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]acetate Traditional Name: 2-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]acetate Formula: C10H12N3O2- MolecularWeight: 206.22118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CC(=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CC(=O)[O-]

InChI

InChI=1S/C10H13N3O2/c1-7-9(6-10(14)15)8(2)13(12-7)5-3-4-11/h3,5-6H2,1-2H3,(H,14,15)/p-1