2-azanyl-9-[1,1,2,2-tetradeuterio-3-(hydroxymethyl)-4-oxidanyl-butyl]-5H-purin-6-one

Systemtic Name: 2-azanyl-9-[1,1,2,2-tetradeuterio-3-(hydroxymethyl)-4-oxidanyl-butyl]-5H-purin-6-one Openeye Name: 2-amino-9-[1,1,2,2-tetradeuterio-4-hydroxy-3-(hydroxymethyl)butyl]-5H-purin-6-one CAS Name: 2-amino-9-[1,1,2,2-tetradeuterio-4-hydroxy-3-(hydroxymethyl)butyl]-5H-purin-6-one IUPAC Name: 2-amino-9-[1,1,2,2-tetradeuterio-4-hydroxy-3-(hydroxymethyl)butyl]-5H-purin-6-one Traditional Name: 2-amino-9-(1,1,2,2-tetradeuterio-4-hydroxy-3-methylol-butyl)-5H-purin-6-one Formula: C10H15N5O3 MolecularWeight: 257.282447

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2C(=NC(=NC2=O)N)N1CCC(CO)CO

Isomeric SMILES

[2H]C([2H])(C(CO)CO)C([2H])([2H])N1C=NC2C1=NC(=NC2=O)N

InChI

InChI=1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)12-5-15(8)2-1-6(3-16)4-17/h5-7,16-17H,1-4H2,(H2,11,14,18)/i1D2,2D2