[(1S,2R,3R)-2-(acetyloxymethyl)-3-(6-aminopurin-9-yl)cyclobutyl]methyl ethanoate

Systemtic Name: [(1S,2R,3R)-2-(acetyloxymethyl)-3-(6-aminopurin-9-yl)cyclobutyl]methyl ethanoate Openeye Name: [(1S,2R,3R)-2-(acetoxymethyl)-3-(6-aminopurin-9-yl)cyclobutyl]methyl acetate CAS Name: acetic acid [(1S,2R,3R)-2-(acetyloxymethyl)-3-(6-aminopurin-9-yl)cyclobutyl]methyl ester IUPAC Name: [(1S,2R,3R)-2-(acetyloxymethyl)-3-(6-aminopurin-9-yl)cyclobutyl]methyl acetate Traditional Name: acetic acid [(1S,2R,3R)-2-(acetoxymethyl)-3-adenin-9-yl-cyclobutyl]methyl ester Formula: C15H19N5O4 MolecularWeight: 333.34246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC(C1COC(=O)C)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CC(=O)OC[C@H]1C[C@H]([C@@H]1COC(=O)C)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C15H19N5O4/c1-8(21)23-4-10-3-12(11(10)5-24-9(2)22)20-7-19-13-14(16)17-6-18-15(13)20/h6-7,10-12H,3-5H2,1-2H3,(H2,16,17,18)/t10-,11-,12-/m1/s1