2-[4-(4-azanyl-2,5-dimethyl-pyrazol-3-yl)oxyphenyl]ethanenitrile

Systemtic Name: 2-[4-(4-azanyl-2,5-dimethyl-pyrazol-3-yl)oxyphenyl]ethanenitrile Openeye Name: 2-[4-(4-amino-2,5-dimethyl-pyrazol-3-yl)oxyphenyl]acetonitrile CAS Name: 2-[4-[(4-amino-2,5-dimethyl-3-pyrazolyl)oxy]phenyl]acetonitrile IUPAC Name: 2-[4-(4-amino-2,5-dimethylpyrazol-3-yl)oxyphenyl]acetonitrile Traditional Name: 2-[4-(4-amino-2,5-dimethyl-pyrazol-3-yl)oxyphenyl]acetonitrile Formula: C13H14N4O MolecularWeight: 242.27646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1N)OC2=CC=C(C=C2)CC#N)C

Isomeric SMILES

CC1=NN(C(=C1N)OC2=CC=C(C=C2)CC#N)C

InChI

InChI=1S/C13H14N4O/c1-9-12(15)13(17(2)16-9)18-11-5-3-10(4-6-11)7-8-14/h3-6H,7,15H2,1-2H3