4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile CAS Name: 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1-pyrazolyl]benzonitrile IUPAC Name: 4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile Traditional Name: 4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile Formula: C18H12F3N3 MolecularWeight: 327.30319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C#N)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C#N)C(F)(F)F

InChI

InChI=1S/C18H12F3N3/c1-12-2-6-14(7-3-12)16-10-17(18(19,20)21)23-24(16)15-8-4-13(11-22)5-9-15/h2-10H,1H3