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2-methyl-4,7-dinitro-1-oxidanidyl-3-oxidanyl-benzimidazol-1-ium

2-methyl-4,7-dinitro-1-oxidanidyl-3-oxidanyl-benzimidazol-1-ium

Systemtic Name:2-methyl-4,7-dinitro-1-oxidanidyl-3-oxidanyl-benzimidazol-1-ium
Openeye Name:1-hydroxy-2-methyl-4,7-dinitro-3-oxido-benzimidazol-3-ium
CAS Name:1-hydroxy-2-methyl-4,7-dinitro-3-oxidobenzimidazol-3-ium
IUPAC Name:1-hydroxy-2-methyl-4,7-dinitro-3-oxidobenzimidazol-3-ium
Traditional Name:1-hydroxy-2-methyl-4,7-dinitro-3-oxido-benzimidazol-3-ium
Formula: C8H6N4O6
MolecularWeight: 254.15644
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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(C=CC(=C2N1O)[N+](=O)[O-])[N+](=O)[O-])[O-]


Isomeric SMILES

CC1=[N+](C2=C(C=CC(=C2N1O)[N+](=O)[O-])[N+](=O)[O-])[O-]


InChI

InChI=1S/C8H6N4O6/c1-4-9(13)7-5(11(15)16)2-3-6(12(17)18)8(7)10(4)14/h2-3,13H,1H3


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