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1-(trideuteriomethyl)purine-2,6-dione

1-(trideuteriomethyl)purine-2,6-dione

Systemtic Name:1-(trideuteriomethyl)purine-2,6-dione
Openeye Name:1-(trideuteriomethyl)purine-2,6-dione
CAS Name:1-(trideuteriomethyl)purine-2,6-dione
IUPAC Name:1-(trideuteriomethyl)purine-2,6-dione
Traditional Name:1-(trideuteriomethyl)xanthine
Formula: C6H4N4O2
MolecularWeight: 167.140045
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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=NC=NC2=NC1=O


Isomeric SMILES

[2H]C([2H])([2H])N1C(=O)C2=NC=NC2=NC1=O


InChI

InChI=1S/C6H4N4O2/c1-10-5(11)3-4(8-2-7-3)9-6(10)12/h2H,1H3/i1D3


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