1-(2-cyanoethyl)-5-ethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(2-cyanoethyl)-5-ethyl-pyrazole-4-carboxylic acid Openeye Name: 1-(2-cyanoethyl)-5-ethyl-pyrazole-4-carboxylic acid CAS Name: 1-(2-cyanoethyl)-5-ethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(2-cyanoethyl)-5-ethylpyrazole-4-carboxylic acid Traditional Name: 1-(2-cyanoethyl)-5-ethyl-pyrazole-4-carboxylic acid Formula: C9H11N3O2 MolecularWeight: 193.20254

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1CCC#N)C(=O)O

Isomeric SMILES

CCC1=C(C=NN1CCC#N)C(=O)O

InChI

InChI=1S/C9H11N3O2/c1-2-8-7(9(13)14)6-11-12(8)5-3-4-10/h6H,2-3,5H2,1H3,(H,13,14)