3-[2-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzenecarbonitrile

Systemtic Name: 3-[2-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzenecarbonitrile Openeye Name: 3-[2-(p-tolyl)-5-(trifluoromethyl)pyrazol-3-yl]benzonitrile CAS Name: 3-[2-(4-methylphenyl)-5-(trifluoromethyl)-3-pyrazolyl]benzonitrile IUPAC Name: 3-[2-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzonitrile Traditional Name: 3-[2-(p-tolyl)-5-(trifluoromethyl)pyrazol-3-yl]benzonitrile Formula: C18H12F3N3 MolecularWeight: 327.30319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=CC(=C3)C#N

InChI

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