1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperazin-4-ium chloride

Systemtic Name: 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperazin-4-ium chloride Openeye Name: 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperazin-4-ium chloride CAS Name: 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperazin-4-ium chloride IUPAC Name: 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperazin-4-ium chloride Traditional Name: 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperazin-4-ium chloride Formula: C8H14ClN5O2 MolecularWeight: 247.68206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1)[N+](=O)[O-])N2CC[NH2+]CC2.[Cl-]

Isomeric SMILES

CC1=NC(=C(N1)[N+](=O)[O-])N2CC[NH2+]CC2.[Cl-]

InChI

InChI=1S/C8H13N5O2.ClH/c1-6-10-7(8(11-6)13(14)15)12-4-2-9-3-5-12;/h9H,2-5H2,1H3,(H,10,11);1H