2-azanyl-9-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-8-methoxy-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-8-methoxy-3H-purin-6-one Openeye Name: 2-amino-9-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-8-methoxy-3H-purin-6-one CAS Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-8-methoxy-3H-purin-6-one IUPAC Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-8-methoxy-3H-purin-6-one Traditional Name: 2-amino-9-[(2-hydroxy-1-methylol-ethoxy)methyl]-8-methoxy-3H-purin-6-one Formula: C10H15N5O5 MolecularWeight: 285.2566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(N1COC(CO)CO)NC(=NC2=O)N

Isomeric SMILES

COC1=NC2=C(N1COC(CO)CO)NC(=NC2=O)N

InChI

InChI=1S/C10H15N5O5/c1-19-10-12-6-7(13-9(11)14-8(6)18)15(10)4-20-5(2-16)3-17/h5,16-17H,2-4H2,1H3,(H3,11,13,14,18)