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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]propanoate IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propionate Formula: C11H14N3O2- MolecularWeight: 220.24776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O2/c1-8-10(4-5-11(15)16)9(2)14(13-8)7-3-6-12/h3-5,7H2,1-2H3,(H,15,16)/p-1