[2-acetyloxy-3-(6-aminopurin-9-yl)propyl] ethanoate

Systemtic Name: [2-acetyloxy-3-(6-aminopurin-9-yl)propyl] ethanoate Openeye Name: [2-acetoxy-3-(6-aminopurin-9-yl)propyl] acetate CAS Name: acetic acid [2-acetyloxy-3-(6-aminopurin-9-yl)propyl] ester IUPAC Name: [2-acetyloxy-3-(6-aminopurin-9-yl)propyl] acetate Traditional Name: acetic acid (2-acetoxy-3-adenin-9-yl-propyl) ester Formula: C12H15N5O4 MolecularWeight: 293.2786

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CN1C=NC2=C1N=CN=C2N)OC(=O)C

Isomeric SMILES

CC(=O)OCC(CN1C=NC2=C1N=CN=C2N)OC(=O)C

InChI

InChI=1S/C12H15N5O4/c1-7(18)20-4-9(21-8(2)19)3-17-6-16-10-11(13)14-5-15-12(10)17/h5-6,9H,3-4H2,1-2H3,(H2,13,14,15)