3-nitro-4-(pyridin-2-ylmethyl)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(pyridin-2-ylmethyl)benzenecarbonitrile Openeye Name: 3-nitro-4-(2-pyridylmethyl)benzonitrile CAS Name: 3-nitro-4-(2-pyridinylmethyl)benzonitrile IUPAC Name: 3-nitro-4-(pyridin-2-ylmethyl)benzonitrile Traditional Name: 3-nitro-4-(2-pyridylmethyl)benzonitrile Formula: C13H9N3O2 MolecularWeight: 239.22946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O2/c14-9-10-4-5-11(13(7-10)16(17)18)8-12-3-1-2-6-15-12/h1-7H,8H2