2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethanenitrile

Systemtic Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethanenitrile Openeye Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]acetonitrile CAS Name: 2-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]acetonitrile IUPAC Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]acetonitrile Traditional Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]acetonitrile Formula: C13H13N3 MolecularWeight: 211.26242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)CC#N)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)CC#N)C

InChI

InChI=1S/C13H13N3/c1-10-9-11(2)16(15-10)13-5-3-12(4-6-13)7-8-14/h3-6,9H,7H2,1-2H3