4-[2-(4-nitrophenyl)ethyl-(1,2,4-triazol-4-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[2-(4-nitrophenyl)ethyl-(1,2,4-triazol-4-yl)amino]benzenecarbonitrile Openeye Name: 4-[2-(4-nitrophenyl)ethyl-(1,2,4-triazol-4-yl)amino]benzonitrile CAS Name: 4-[2-(4-nitrophenyl)ethyl-(1,2,4-triazol-4-yl)amino]benzonitrile IUPAC Name: 4-[2-(4-nitrophenyl)ethyl-(1,2,4-triazol-4-yl)amino]benzonitrile Traditional Name: 4-[2-(4-nitrophenyl)ethyl-(1,2,4-triazol-4-yl)amino]benzonitrile Formula: C17H14N6O2 MolecularWeight: 334.33206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCN(C2=CC=C(C=C2)C#N)N3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCN(C2=CC=C(C=C2)C#N)N3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O2/c18-11-15-3-5-16(6-4-15)22(21-12-19-20-13-21)10-9-14-1-7-17(8-2-14)23(24)25/h1-8,12-13H,9-10H2