cyanomethyl 3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: cyanomethyl 3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: cyanomethyl 1-phenyl-3-(p-tolyl)pyrazole-4-carboxylate CAS Name: 3-(4-methylphenyl)-1-phenyl-4-pyrazolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(4-methylphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(p-tolyl)pyrazole-4-carboxylic acid cyanomethyl ester Formula: C19H15N3O2 MolecularWeight: 317.3413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC#N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC#N)C3=CC=CC=C3

InChI

InChI=1S/C19H15N3O2/c1-14-7-9-15(10-8-14)18-17(19(23)24-12-11-20)13-22(21-18)16-5-3-2-4-6-16/h2-10,13H,12H2,1H3