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2-(azocan-1-ium-1-ylmethyl)-6-nitro-1H-benzimidazole

2-(azocan-1-ium-1-ylmethyl)-6-nitro-1H-benzimidazole

Systemtic Name:2-(azocan-1-ium-1-ylmethyl)-6-nitro-1H-benzimidazole
Openeye Name:2-(azocan-1-ium-1-ylmethyl)-6-nitro-1H-benzimidazole
CAS Name:2-(1-azocan-1-iumylmethyl)-6-nitro-1H-benzimidazole
IUPAC Name:2-(azocan-1-ium-1-ylmethyl)-6-nitro-1H-benzimidazole
Traditional Name:2-(azocan-1-ium-1-ylmethyl)-6-nitro-1H-benzimidazole
Formula: C15H21N4O2+
MolecularWeight: 289.35284
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

C1CCC[NH+](CCC1)CC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]


InChI

InChI=1S/C15H20N4O2/c20-19(21)12-6-7-13-14(10-12)17-15(16-13)11-18-8-4-2-1-3-5-9-18/h6-7,10H,1-5,8-9,11H2,(H,16,17)/p+1


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