2-(2-methyl-5-nitro-imidazol-1-yl)ethanamine hydrate dihydrochloride

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethanamine hydrate dihydrochloride Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethanamine hydrate dihydrochloride CAS Name: 2-(2-methyl-5-nitro-1-imidazolyl)ethanamine hydrate dihydrochloride IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethanamine hydrate dihydrochloride Traditional Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethylamine hydrate dihydrochloride Formula: C6H14Cl2N4O3 MolecularWeight: 261.10636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCN)[N+](=O)[O-].O.Cl.Cl

Isomeric SMILES

CC1=NC=C(N1CCN)[N+](=O)[O-].O.Cl.Cl

InChI

InChI=1S/C6H10N4O2.2ClH.H2O/c1-5-8-4-6(10(11)12)9(5)3-2-7;;;/h4H,2-3,7H2,1H3;2*1H;1H2