4-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(5-nitro-2-oxo-1-pyridyl)methyl]benzonitrile CAS Name: 4-[(5-nitro-2-oxo-1-pyridinyl)methyl]benzonitrile IUPAC Name: 4-[(5-nitro-2-oxopyridin-1-yl)methyl]benzonitrile Traditional Name: 4-[(2-keto-5-nitro-1-pyridyl)methyl]benzonitrile Formula: C13H9N3O3 MolecularWeight: 255.22886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=C(C=CC2=O)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=C(C=CC2=O)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H9N3O3/c14-7-10-1-3-11(4-2-10)8-15-9-12(16(18)19)5-6-13(15)17/h1-6,9H,8H2