2-[(3-nitropyrazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(3-nitropyrazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(3-nitropyrazol-1-yl)methyl]benzonitrile CAS Name: 2-[(3-nitro-1-pyrazolyl)methyl]benzonitrile IUPAC Name: 2-[(3-nitropyrazol-1-yl)methyl]benzonitrile Traditional Name: 2-[(3-nitropyrazol-1-yl)methyl]benzonitrile Formula: C11H8N4O2 MolecularWeight: 228.20682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=N2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=N2)[N+](=O)[O-])C#N

InChI

InChI=1S/C11H8N4O2/c12-7-9-3-1-2-4-10(9)8-14-6-5-11(13-14)15(16)17/h1-6H,8H2