[3-acetyloxy-2-[(2-azanyl-6-chloranyl-purin-9-yl)methoxy]propyl] ethanoate

Systemtic Name: [3-acetyloxy-2-[(2-azanyl-6-chloranyl-purin-9-yl)methoxy]propyl] ethanoate Openeye Name: [3-acetoxy-2-[(2-amino-6-chloro-purin-9-yl)methoxy]propyl] acetate CAS Name: acetic acid [3-acetyloxy-2-[(2-amino-6-chloro-9-purinyl)methoxy]propyl] ester IUPAC Name: [3-acetyloxy-2-[(2-amino-6-chloropurin-9-yl)methoxy]propyl] acetate Traditional Name: acetic acid [3-acetoxy-2-[(2-amino-6-chloro-purin-9-yl)methoxy]propyl] ester Formula: C13H16ClN5O5 MolecularWeight: 357.74964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(COC(=O)C)OCN1C=NC2=C1N=C(N=C2Cl)N

Isomeric SMILES

CC(=O)OCC(COC(=O)C)OCN1C=NC2=C1N=C(N=C2Cl)N

InChI

InChI=1S/C13H16ClN5O5/c1-7(20)22-3-9(4-23-8(2)21)24-6-19-5-16-10-11(14)17-13(15)18-12(10)19/h5,9H,3-4,6H2,1-2H3,(H2,15,17,18)