3-(4-iodanyl-2-nitro-imidazol-2-yl)propane-1,2-diol

Systemtic Name: 3-(4-iodanyl-2-nitro-imidazol-2-yl)propane-1,2-diol Openeye Name: 3-(4-iodo-2-nitro-imidazol-2-yl)propane-1,2-diol CAS Name: 3-(4-iodo-2-nitro-2-imidazolyl)propane-1,2-diol IUPAC Name: 3-(4-iodo-2-nitroimidazol-2-yl)propane-1,2-diol Traditional Name: 3-(4-iodo-2-nitro-imidazol-2-yl)propane-1,2-diol Formula: C6H8IN3O4 MolecularWeight: 313.04989

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(N=C1I)(CC(CO)O)[N+](=O)[O-]

Isomeric SMILES

C1=NC(N=C1I)(CC(CO)O)[N+](=O)[O-]

InChI

InChI=1S/C6H8IN3O4/c7-5-2-8-6(9-5,10(13)14)1-4(12)3-11/h2,4,11-12H,1,3H2