2-azanyl-3,7-dihydropurin-6-one trihydrate dihydroiodide

Systemtic Name: 2-azanyl-3,7-dihydropurin-6-one trihydrate dihydroiodide Openeye Name: 2-amino-3,7-dihydropurin-6-one trihydrate dihydroiodide CAS Name: 2-amino-3,7-dihydropurin-6-one trihydrate dihydroiodide IUPAC Name: 2-amino-3,7-dihydropurin-6-one trihydrate dihydroiodide Traditional Name: 2-amino-3,7-dihydropurin-6-one trihydrate dihydroiodide Formula: C10H18I2N10O5 MolecularWeight: 612.12286

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=O)N=C(N2)N.C1=NC2=C(N1)C(=O)N=C(N2)N.O.O.O.I.I

Isomeric SMILES

C1=NC2=C(N1)C(=O)N=C(N2)N.C1=NC2=C(N1)C(=O)N=C(N2)N.O.O.O.I.I

InChI

InChI=1S/2C5H5N5O.2HI.3H2O/c2*6-5-9-3-2(4(11)10-5)7-1-8-3;;;;;/h2*1H,(H4,6,7,8,9,10,11);2*1H;3*1H2