3-[[(4-nitrophenyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(4-nitrophenyl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[(4-nitroanilino)methyl]benzonitrile CAS Name: 3-[(4-nitroanilino)methyl]benzonitrile IUPAC Name: 3-[(4-nitroanilino)methyl]benzonitrile Traditional Name: 3-[(4-nitroanilino)methyl]benzonitrile Formula: C14H11N3O2 MolecularWeight: 253.25604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O2/c15-9-11-2-1-3-12(8-11)10-16-13-4-6-14(7-5-13)17(18)19/h1-8,16H,10H2