2-[(3-nitro-1,2,4-triazol-1-yl)methoxy]propane-1,3-diol

Systemtic Name: 2-[(3-nitro-1,2,4-triazol-1-yl)methoxy]propane-1,3-diol Openeye Name: 2-[(3-nitro-1,2,4-triazol-1-yl)methoxy]propane-1,3-diol CAS Name: 2-[(3-nitro-1,2,4-triazol-1-yl)methoxy]propane-1,3-diol IUPAC Name: 2-[(3-nitro-1,2,4-triazol-1-yl)methoxy]propane-1,3-diol Traditional Name: 2-[(3-nitro-1,2,4-triazol-1-yl)methoxy]propane-1,3-diol Formula: C6H10N4O5 MolecularWeight: 218.1674

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=NN1COC(CO)CO)[N+](=O)[O-]

Isomeric SMILES

C1=NC(=NN1COC(CO)CO)[N+](=O)[O-]

InChI

InChI=1S/C6H10N4O5/c11-1-5(2-12)15-4-9-3-7-6(8-9)10(13)14/h3,5,11-12H,1-2,4H2