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

Systemtic Name: 2-azanyl-9-[3-[1,3-bis(oxidanyl)propan-2-yloxy]propyl]-3H-purin-6-one Openeye Name: 2-amino-9-[3-[2-hydroxy-1-(hydroxymethyl)ethoxy]propyl]-3H-purin-6-one CAS Name: 2-amino-9-[3-(1,3-dihydroxypropan-2-yloxy)propyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[3-(1,3-dihydroxypropan-2-yloxy)propyl]-3H-purin-6-one Traditional Name: 2-amino-9-[3-(2-hydroxy-1-methylol-ethoxy)propyl]-3H-purin-6-one Formula: C11H17N5O4 MolecularWeight: 283.28378

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCCOC(CO)CO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CCCOC(CO)CO)NC(=NC2=O)N

InChI

InChI=1S/C11H17N5O4/c12-11-14-9-8(10(19)15-11)13-6-16(9)2-1-3-20-7(4-17)5-18/h6-7,17-18H,1-5H2,(H3,12,14,15,19)