(1-chloranyl-2-methyl-propan-2-yl)-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]azanium chloride

Systemtic Name: (1-chloranyl-2-methyl-propan-2-yl)-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]azanium chloride Openeye Name: (2-chloro-1,1-dimethyl-ethyl)-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]ammonium chloride CAS Name: (1-chloro-2-methylpropan-2-yl)-[2-hydroxy-3-(2-nitro-1-imidazolyl)propyl]ammonium chloride IUPAC Name: (1-chloro-2-methylpropan-2-yl)-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]azanium chloride Traditional Name: (2-chloro-1,1-dimethyl-ethyl)-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]ammonium chloride Formula: C10H18Cl2N4O3 MolecularWeight: 313.18092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)[NH2+]CC(CN1C=CN=C1[N+](=O)[O-])O.[Cl-]

Isomeric SMILES

CC(C)(CCl)[NH2+]CC(CN1C=CN=C1[N+](=O)[O-])O.[Cl-]

InChI

InChI=1S/C10H17ClN4O3.ClH/c1-10(2,7-11)13-5-8(16)6-14-4-3-12-9(14)15(17)18;/h3-4,8,13,16H,5-7H2,1-2H3;1H