2-methyl-1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]-5-nitro-imidazole

Systemtic Name: 2-methyl-1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]-5-nitro-imidazole Openeye Name: 2-methyl-1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]-5-nitro-imidazole CAS Name: 2-methyl-1-[2-(3-methyl-1-imidazol-3-iumyl)ethyl]-5-nitroimidazole IUPAC Name: 2-methyl-1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]-5-nitroimidazole Traditional Name: 2-methyl-1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]-5-nitro-imidazole Formula: C10H14N5O2+ MolecularWeight: 236.25046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCN2C=C[N+](=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCN2C=C[N+](=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C10H14N5O2/c1-9-11-7-10(15(16)17)14(9)6-5-13-4-3-12(2)8-13/h3-4,7-8H,5-6H2,1-2H3/q+1