N3-(4-nitrophenyl)-5-phenyl-1,2,4-triazole-3,4-diamine

Systemtic Name: N3-(4-nitrophenyl)-5-phenyl-1,2,4-triazole-3,4-diamine Openeye Name: N3-(4-nitrophenyl)-5-phenyl-1,2,4-triazole-3,4-diamine CAS Name: N3-(4-nitrophenyl)-5-phenyl-1,2,4-triazole-3,4-diamine IUPAC Name: 3-N-(4-nitrophenyl)-5-phenyl-1,2,4-triazole-3,4-diamine Traditional Name: (4-amino-5-phenyl-1,2,4-triazol-3-yl)-(4-nitrophenyl)amine Formula: C14H12N6O2 MolecularWeight: 296.28408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2N)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2N)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N6O2/c15-19-13(10-4-2-1-3-5-10)17-18-14(19)16-11-6-8-12(9-7-11)20(21)22/h1-9H,15H2,(H,16,18)