[3-acetyloxy-2-[(2-azanylpurin-7-yl)methoxy]propyl] ethanoate

Systemtic Name: [3-acetyloxy-2-[(2-azanylpurin-7-yl)methoxy]propyl] ethanoate Openeye Name: [3-acetoxy-2-[(2-aminopurin-7-yl)methoxy]propyl] acetate CAS Name: acetic acid [3-acetyloxy-2-[(2-amino-7-purinyl)methoxy]propyl] ester IUPAC Name: [3-acetyloxy-2-[(2-aminopurin-7-yl)methoxy]propyl] acetate Traditional Name: acetic acid [3-acetoxy-2-[(2-aminopurin-7-yl)methoxy]propyl] ester Formula: C13H17N5O5 MolecularWeight: 323.30458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(COC(=O)C)OCN1C=NC2=NC(=NC=C21)N

Isomeric SMILES

CC(=O)OCC(COC(=O)C)OCN1C=NC2=NC(=NC=C21)N

InChI

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