cyanomethyl 5-(4-chlorophenyl)-2-phenyl-pyrazole-3-carboxylate

Systemtic Name: cyanomethyl 5-(4-chlorophenyl)-2-phenyl-pyrazole-3-carboxylate Openeye Name: cyanomethyl 5-(4-chlorophenyl)-2-phenyl-pyrazole-3-carboxylate CAS Name: 5-(4-chlorophenyl)-2-phenyl-3-pyrazolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 5-(4-chlorophenyl)-2-phenylpyrazole-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-2-phenyl-pyrazole-3-carboxylic acid cyanomethyl ester Formula: C18H12ClN3O2 MolecularWeight: 337.75978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC#N

InChI

InChI=1S/C18H12ClN3O2/c19-14-8-6-13(7-9-14)16-12-17(18(23)24-11-10-20)22(21-16)15-4-2-1-3-5-15/h1-9,12H,11H2