2-(2-azanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)ethanoic acid dihydrate

Systemtic Name: 2-(2-azanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)ethanoic acid dihydrate Openeye Name: 2-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)acetic acid dihydrate CAS Name: 2-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)acetic acid dihydrate IUPAC Name: 2-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)acetic acid dihydrate Traditional Name: 2-(2-amino-4-hydroxy-6-keto-1H-pyrimidin-5-yl)acetic acid dihydrate Formula: C6H11N3O6 MolecularWeight: 221.16804

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=C(N=C(NC1=O)N)O)C(=O)O.O.O

Isomeric SMILES

C(C1=C(N=C(NC1=O)N)O)C(=O)O.O.O

InChI

InChI=1S/C6H7N3O4.2H2O/c7-6-8-4(12)2(1-3(10)11)5(13)9-6;;/h1H2,(H,10,11)(H4,7,8,9,12,13);2*1H2