3-(4-nitrophenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole

Systemtic Name: 3-(4-nitrophenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole Openeye Name: 3-(4-nitrophenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole CAS Name: 3-(4-nitrophenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole IUPAC Name: 3-(4-nitrophenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole Traditional Name: 3-(4-nitrophenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole Formula: C11H9N7O2 MolecularWeight: 271.23486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NNC(=N2)CN3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NNC(=N2)CN3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C11H9N7O2/c19-18(20)9-3-1-8(2-4-9)11-14-10(15-16-11)5-17-7-12-6-13-17/h1-4,6-7H,5H2,(H,14,15,16)