2-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]ethanenitrile

Systemtic Name: 2-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]ethanenitrile Openeye Name: 2-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]acetonitrile CAS Name: 2-[5-(4-methylphenyl)-2-phenyl-3-pyrazolyl]acetonitrile IUPAC Name: 2-[5-(4-methylphenyl)-2-phenylpyrazol-3-yl]acetonitrile Traditional Name: 2-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]acetonitrile Formula: C18H15N3 MolecularWeight: 273.3318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2)CC#N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2)CC#N)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3/c1-14-7-9-15(10-8-14)18-13-17(11-12-19)21(20-18)16-5-3-2-4-6-16/h2-10,13H,11H2,1H3