5-nitro-1,3-diazinane-2,4,6-trione hydrate

Systemtic Name: 5-nitro-1,3-diazinane-2,4,6-trione hydrate Openeye Name: 5-nitrohexahydropyrimidine-2,4,6-trione hydrate CAS Name: 5-nitro-1,3-diazinane-2,4,6-trione hydrate IUPAC Name: 5-nitro-1,3-diazinane-2,4,6-trione hydrate Traditional Name: 5-nitrobarbituric acid hydrate Formula: C4H5N3O6 MolecularWeight: 191.099

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Descriptors Computed from Structure

Canonical SMILES:

C1(C(=O)NC(=O)NC1=O)[N+](=O)[O-].O

Isomeric SMILES

C1(C(=O)NC(=O)NC1=O)[N+](=O)[O-].O

InChI

InChI=1S/C4H3N3O5.H2O/c8-2-1(7(11)12)3(9)6-4(10)5-2;/h1H,(H2,5,6,8,9,10);1H2