1-oxidanylidene-3-[1,2,2-tris(oxidanyl)ethyl]-1,2,3-triazolidin-1-ium-4-one

Systemtic Name: 1-oxidanylidene-3-[1,2,2-tris(oxidanyl)ethyl]-1,2,3-triazolidin-1-ium-4-one Openeye Name: 1-oxo-3-(1,2,2-trihydroxyethyl)triazolidin-1-ium-4-one CAS Name: 1-oxo-3-(1,2,2-trihydroxyethyl)-4-triazolidin-1-iumone IUPAC Name: 1-oxo-3-(1,2,2-trihydroxyethyl)triazolidin-1-ium-4-one Traditional Name: 1-keto-3-(1,2,2-trihydroxyethyl)triazolidin-1-ium-4-one Formula: C4H8N3O5+ MolecularWeight: 178.12342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(N[N+]1=O)C(C(O)O)O

Isomeric SMILES

C1C(=O)N(N[N+]1=O)C(C(O)O)O

InChI

InChI=1S/C4H8N3O5/c8-2-1-6(12)5-7(2)3(9)4(10)11/h3-4,9-11H,1H2,(H,5,12)/q+1