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

Systemtic Name: (4-cyanophenyl)methyl 3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: (4-cyanophenyl)methyl 3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(4-chlorophenyl)-1-phenyl-4-pyrazolecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-(4-chlorophenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxylic acid (4-cyanobenzyl) ester Formula: C24H16ClN3O2 MolecularWeight: 413.85574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H16ClN3O2/c25-20-12-10-19(11-13-20)23-22(15-28(27-23)21-4-2-1-3-5-21)24(29)30-16-18-8-6-17(14-26)7-9-18/h1-13,15H,16H2