2-azanyl-1,5-dihydropteridine-4,6-dione hydrate

Systemtic Name: 2-azanyl-1,5-dihydropteridine-4,6-dione hydrate Openeye Name: 2-amino-1,5-dihydropteridine-4,6-dione hydrate CAS Name: 2-amino-1,5-dihydropteridine-4,6-dione hydrate IUPAC Name: 2-amino-1,5-dihydropteridine-4,6-dione hydrate Traditional Name: 2-amino-1,5-dihydropteridine-4,6-quinone hydrate Formula: C6H7N5O3 MolecularWeight: 197.15148

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=O)N=C(N2)N)NC1=O.O

Isomeric SMILES

C1=NC2=C(C(=O)N=C(N2)N)NC1=O.O

InChI

InChI=1S/C6H5N5O2.H2O/c7-6-10-4-3(5(13)11-6)9-2(12)1-8-4;/h1H,(H,9,12)(H3,7,8,10,11,13);1H2