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

Systemtic Name: [(2R)-3-(6-acetamidopurin-9-yl)-2-acetyloxy-propyl] ethanoate Openeye Name: [(2R)-3-(6-acetamidopurin-9-yl)-2-acetoxy-propyl] acetate CAS Name: acetic acid [(2R)-3-(6-acetamido-9-purinyl)-2-acetyloxypropyl] ester IUPAC Name: [(2R)-3-(6-acetamidopurin-9-yl)-2-acetyloxypropyl] acetate Traditional Name: acetic acid [(2R)-3-(6-acetamidopurin-9-yl)-2-acetoxy-propyl] ester Formula: C14H17N5O5 MolecularWeight: 335.31528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=NC2=C1N=CN2CC(COC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1=NC=NC2=C1N=CN2C[C@H](COC(=O)C)OC(=O)C

InChI

InChI=1S/C14H17N5O5/c1-8(20)18-13-12-14(16-6-15-13)19(7-17-12)4-11(24-10(3)22)5-23-9(2)21/h6-7,11H,4-5H2,1-3H3,(H,15,16,18,20)/t11-/m1/s1