1,3-diazinane-2,4,5,6-tetrone; pyridine-3-carboxamide; hydrate

Systemtic Name: 1,3-diazinane-2,4,5,6-tetrone; pyridine-3-carboxamide; hydrate Openeye Name: hexahydropyrimidine-2,4,5,6-tetrone; pyridine-3-carboxamide; hydrate CAS Name: 1,3-diazinane-2,4,5,6-tetrone; 3-pyridinecarboxamide; hydrate IUPAC Name: 1,3-diazinane-2,4,5,6-tetrone; pyridine-3-carboxamide; hydrate Traditional Name: alloxane; nicotinamide; hydrate Formula: C10H10N4O6 MolecularWeight: 282.2096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)N.C1(=O)C(=O)NC(=O)NC1=O.O

Isomeric SMILES

C1=CC(=CN=C1)C(=O)N.C1(=O)C(=O)NC(=O)NC1=O.O

InChI

InChI=1S/C6H6N2O.C4H2N2O4.H2O/c7-6(9)5-2-1-3-8-4-5;7-1-2(8)5-4(10)6-3(1)9;/h1-4H,(H2,7,9);(H2,5,6,8,9,10);1H2