2-(3-cyanophenyl)-5-ethyl-pyrazole-3-carboxylic acid

Systemtic Name: 2-(3-cyanophenyl)-5-ethyl-pyrazole-3-carboxylic acid Openeye Name: 2-(3-cyanophenyl)-5-ethyl-pyrazole-3-carboxylic acid CAS Name: 2-(3-cyanophenyl)-5-ethyl-3-pyrazolecarboxylic acid IUPAC Name: 2-(3-cyanophenyl)-5-ethylpyrazole-3-carboxylic acid Traditional Name: 2-(3-cyanophenyl)-5-ethyl-pyrazole-3-carboxylic acid Formula: C13H11N3O2 MolecularWeight: 241.24534

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)C(=O)O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCC1=NN(C(=C1)C(=O)O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H11N3O2/c1-2-10-7-12(13(17)18)16(15-10)11-5-3-4-9(6-11)8-14/h3-7H,2H2,1H3,(H,17,18)