[2-(acetyloxymethyl)-3-(2-azanylpurin-9-yl)oxy-propyl] ethanoate

Systemtic Name: [2-(acetyloxymethyl)-3-(2-azanylpurin-9-yl)oxy-propyl] ethanoate Openeye Name: [2-(acetoxymethyl)-3-(2-aminopurin-9-yl)oxy-propyl] acetate CAS Name: acetic acid [2-(acetyloxymethyl)-3-[(2-amino-9-purinyl)oxy]propyl] ester IUPAC Name: [2-(acetyloxymethyl)-3-(2-aminopurin-9-yl)oxypropyl] acetate Traditional Name: acetic acid [2-(acetoxymethyl)-3-(2-aminopurin-9-yl)oxy-propyl] ester Formula: C13H17N5O5 MolecularWeight: 323.30458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(COC(=O)C)CON1C=NC2=CN=C(N=C21)N

Isomeric SMILES

CC(=O)OCC(COC(=O)C)CON1C=NC2=CN=C(N=C21)N

InChI

InChI=1S/C13H17N5O5/c1-8(19)21-4-10(5-22-9(2)20)6-23-18-7-16-11-3-15-13(14)17-12(11)18/h3,7,10H,4-6H2,1-2H3,(H2,14,15,17)