3-[(4-nitrophenyl)methylamino]benzenecarbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

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