methyl 1-(4-cyanophenyl)pyrazole-3-carboxylate

Systemtic Name: methyl 1-(4-cyanophenyl)pyrazole-3-carboxylate Openeye Name: methyl 1-(4-cyanophenyl)pyrazole-3-carboxylate CAS Name: 1-(4-cyanophenyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-cyanophenyl)pyrazole-3-carboxylate Traditional Name: 1-(4-cyanophenyl)pyrazole-3-carboxylic acid methyl ester Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O2/c1-17-12(16)11-6-7-15(14-11)10-4-2-9(8-13)3-5-10/h2-7H,1H3