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

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

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N6O2/c1-13(15-4-8-17(9-5-15)23(24)25)22(21-11-19-20-12-21)16-6-2-14(10-18)3-7-16/h2-9,11-13H,1H3