5-nitro-2-(pyridin-3-ylmethylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(pyridin-3-ylmethylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-(3-pyridylmethylamino)benzonitrile CAS Name: 5-nitro-2-(3-pyridinylmethylamino)benzonitrile IUPAC Name: 5-nitro-2-(pyridin-3-ylmethylamino)benzonitrile Traditional Name: 5-nitro-2-(3-pyridylmethylamino)benzonitrile Formula: C13H10N4O2 MolecularWeight: 254.2441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CN=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H10N4O2/c14-7-11-6-12(17(18)19)3-4-13(11)16-9-10-2-1-5-15-8-10/h1-6,8,16H,9H2