2-azanyl-9-[1-methoxy-1,3-bis(oxidanyl)propan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[1-methoxy-1,3-bis(oxidanyl)propan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[2-hydroxy-1-(hydroxymethyl)-2-methoxy-ethyl]-3H-purin-6-one CAS Name: 2-amino-9-(1,3-dihydroxy-1-methoxypropan-2-yl)-3H-purin-6-one IUPAC Name: 2-amino-9-(1,3-dihydroxy-1-methoxypropan-2-yl)-3H-purin-6-one Traditional Name: 2-amino-9-(2-hydroxy-2-methoxy-1-methylol-ethyl)-3H-purin-6-one Formula: C9H13N5O4 MolecularWeight: 255.23062

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(CO)N1C=NC2=C1NC(=NC2=O)N)O

Isomeric SMILES

COC(C(CO)N1C=NC2=C1NC(=NC2=O)N)O

InChI

InChI=1S/C9H13N5O4/c1-18-8(17)4(2-15)14-3-11-5-6(14)12-9(10)13-7(5)16/h3-4,8,15,17H,2H2,1H3,(H3,10,12,13,16)