(5-carboxyoxy-2H-1,2,3-triazol-4-yl) hydrogen carbonate hydrate

Systemtic Name: (5-carboxyoxy-2H-1,2,3-triazol-4-yl) hydrogen carbonate hydrate Openeye Name: (5-carboxyoxy-2H-triazol-4-yl) hydrogen carbonate hydrate CAS Name: carbonic acid (5-carboxyoxy-2H-triazol-4-yl) ester hydrate IUPAC Name: (5-carboxyoxy-2H-triazol-4-yl) hydrogen carbonate hydrate Traditional Name: carbonic acid (5-carboxyoxy-2H-triazol-4-yl) ester hydrate Formula: C4H5N3O7 MolecularWeight: 207.0984

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Descriptors Computed from Structure

Canonical SMILES:

C1(=NNN=C1OC(=O)O)OC(=O)O.O

Isomeric SMILES

C1(=NNN=C1OC(=O)O)OC(=O)O.O

InChI

InChI=1S/C4H3N3O6.H2O/c8-3(9)12-1-2(6-7-5-1)13-4(10)11;/h(H,8,9)(H,10,11)(H,5,6,7);1H2