[4-acetyloxy-3-(6-aminopurin-9-yl)butyl] ethanoate

Systemtic Name: [4-acetyloxy-3-(6-aminopurin-9-yl)butyl] ethanoate Openeye Name: [4-acetoxy-3-(6-aminopurin-9-yl)butyl] acetate CAS Name: acetic acid [4-acetyloxy-3-(6-aminopurin-9-yl)butyl] ester IUPAC Name: [4-acetyloxy-3-(6-aminopurin-9-yl)butyl] acetate Traditional Name: acetic acid (4-acetoxy-3-adenin-9-yl-butyl) ester Formula: C13H17N5O4 MolecularWeight: 307.30518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC(COC(=O)C)N1C=NC2=C1N=CN=C2N

Isomeric SMILES

CC(=O)OCCC(COC(=O)C)N1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C13H17N5O4/c1-8(19)21-4-3-10(5-22-9(2)20)18-7-17-11-12(14)15-6-16-13(11)18/h6-7,10H,3-5H2,1-2H3,(H2,14,15,16)