6-nitro-2-[2-(6-nitro-1H-benzimidazol-3-ium-2-yl)ethyl]-1H-benzimidazole

Systemtic Name: 6-nitro-2-[2-(6-nitro-1H-benzimidazol-3-ium-2-yl)ethyl]-1H-benzimidazole Openeye Name: 6-nitro-2-[2-(6-nitro-1H-benzimidazol-3-ium-2-yl)ethyl]-1H-benzimidazole CAS Name: 6-nitro-2-[2-(6-nitro-1H-benzimidazol-3-ium-2-yl)ethyl]-1H-benzimidazole IUPAC Name: 6-nitro-2-[2-(6-nitro-1H-benzimidazol-3-ium-2-yl)ethyl]-1H-benzimidazole Traditional Name: 6-nitro-2-[2-(6-nitro-1H-benzimidazol-3-ium-2-yl)ethyl]-1H-benzimidazole Formula: C16H13N6O4+ MolecularWeight: 353.31222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=[NH+]2)CCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=[NH+]2)CCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O4/c23-21(24)9-1-3-11-13(7-9)19-15(17-11)5-6-16-18-12-4-2-10(22(25)26)8-14(12)20-16/h1-4,7-8H,5-6H2,(H,17,19)(H,18,20)/p+1