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

Systemtic Name: 3-[(2-acetamido-6-chloranyl-purin-9-yl)-acetyloxy-methoxy]propyl ethanoate Openeye Name: 3-[(2-acetamido-6-chloro-purin-9-yl)-acetoxy-methoxy]propyl acetate CAS Name: acetic acid 3-[(2-acetamido-6-chloro-9-purinyl)-acetyloxymethoxy]propyl ester IUPAC Name: 3-[(2-acetamido-6-chloropurin-9-yl)-acetyloxymethoxy]propyl acetate Traditional Name: acetic acid 3-[(2-acetamido-6-chloro-purin-9-yl)-acetoxy-methoxy]propyl ester Formula: C15H18ClN5O6 MolecularWeight: 399.78632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2C(OCCCOC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2C(OCCCOC(=O)C)OC(=O)C

InChI

InChI=1S/C15H18ClN5O6/c1-8(22)18-14-19-12(16)11-13(20-14)21(7-17-11)15(27-10(3)24)26-6-4-5-25-9(2)23/h7,15H,4-6H2,1-3H3,(H,18,19,20,22)