8-deuterio-3,7-dimethyl-1-(4,4,6,6,6-pentadeuterio-5-oxidanylidene-hexyl)-4,5-dihydropurine-2,6-dione

Systemtic Name: 8-deuterio-3,7-dimethyl-1-(4,4,6,6,6-pentadeuterio-5-oxidanylidene-hexyl)-4,5-dihydropurine-2,6-dione Openeye Name: 8-deuterio-3,7-dimethyl-1-(4,4,6,6,6-pentadeuterio-5-oxo-hexyl)-4,5-dihydropurine-2,6-dione CAS Name: 8-deuterio-3,7-dimethyl-1-(4,4,6,6,6-pentadeuterio-5-oxohexyl)-4,5-dihydropurine-2,6-dione IUPAC Name: 8-deuterio-3,7-dimethyl-1-(4,4,6,6,6-pentadeuterio-5-oxohexyl)-4,5-dihydropurine-2,6-dione Traditional Name: 8-deuterio-3,7-dimethyl-1-(4,4,6,6,6-pentadeuterio-5-keto-hexyl)-4,5-dihydropurine-2,6-quinone Formula: C13H20N4O3 MolecularWeight: 286.359871

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCN1C(=O)C2C(N=CN2C)N(C1=O)C

Isomeric SMILES

[2H]C1=NC2C(N1C)C(=O)N(C(=O)N2C)CCCC([2H])([2H])C(=O)C([2H])([2H])[2H]

InChI

InChI=1S/C13H20N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8,10-11H,4-7H2,1-3H3/i1D3,6D2,8D