(4-cyanophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: (4-cyanophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: (4-cyanophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-(4-chlorophenyl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid (4-cyanophenyl) ester Formula: C18H9ClF3N3O2 MolecularWeight: 391.73117

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)OC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C18H9ClF3N3O2/c19-12-3-5-13(6-4-12)25-16(18(20,21)22)15(10-24-25)17(26)27-14-7-1-11(9-23)2-8-14/h1-8,10H