4-[(3,5-dimethylpyrazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]benzonitrile CAS Name: 4-[(3,5-dimethyl-1-pyrazolyl)methyl]benzonitrile IUPAC Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]benzonitrile Traditional Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]benzonitrile Formula: C13H13N3 MolecularWeight: 211.26242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)C#N)C

InChI

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