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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)C(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)C(=O)OCC#N

InChI

InChI=1S/C19H15N3O2/c20-11-12-24-19(23)17-14-22(13-15-7-3-1-4-8-15)21-18(17)16-9-5-2-6-10-16/h1-10,14H,12-13H2