2-[4-(pyrazol-1-ylmethyl)phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]benzenecarbonitrile Openeye Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]benzonitrile CAS Name: 2-[4-(1-pyrazolylmethyl)phenyl]benzonitrile IUPAC Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]benzonitrile Traditional Name: 2-[4-(pyrazol-1-ylmethyl)phenyl]benzonitrile Formula: C17H13N3 MolecularWeight: 259.30522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C17H13N3/c18-12-16-4-1-2-5-17(16)15-8-6-14(7-9-15)13-20-11-3-10-19-20/h1-11H,13H2