2-bromoethyl-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]azanium bromide

Systemtic Name: 2-bromoethyl-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]azanium bromide Openeye Name: 2-bromoethyl-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]ammonium bromide CAS Name: 2-bromoethyl-[2-hydroxy-3-(2-nitro-1-imidazolyl)propyl]ammonium bromide IUPAC Name: 2-bromoethyl-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]azanium bromide Traditional Name: 2-bromoethyl-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]ammonium bromide Formula: C8H14Br2N4O3 MolecularWeight: 374.02976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=N1)[N+](=O)[O-])CC(C[NH2+]CCBr)O.[Br-]

Isomeric SMILES

C1=CN(C(=N1)[N+](=O)[O-])CC(C[NH2+]CCBr)O.[Br-]

InChI

InChI=1S/C8H13BrN4O3.BrH/c9-1-2-10-5-7(14)6-12-4-3-11-8(12)13(15)16;/h3-4,7,10,14H,1-2,5-6H2;1H