[(2R,3S,5R)-5-(2-acetamido-6-methoxy-purin-9-yl)-2-acetyloxy-oxolan-3-yl] ethanoate

Systemtic Name: [(2R,3S,5R)-5-(2-acetamido-6-methoxy-purin-9-yl)-2-acetyloxy-oxolan-3-yl] ethanoate Openeye Name: [(2R,3S,5R)-5-(2-acetamido-6-methoxy-purin-9-yl)-2-acetoxy-tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(2R,3S,5R)-5-(2-acetamido-6-methoxy-9-purinyl)-2-acetyloxy-3-oxolanyl] ester IUPAC Name: [(2R,3S,5R)-5-(2-acetamido-6-methoxypurin-9-yl)-2-acetyloxyoxolan-3-yl] acetate Traditional Name: acetic acid [(2R,3S,5R)-5-(2-acetamido-6-methoxy-purin-9-yl)-2-acetoxy-tetrahydrofuran-3-yl] ester Formula: C16H19N5O7 MolecularWeight: 393.35136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)OC)N=CN2C3CC(C(O3)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)OC)N=CN2[C@H]3C[C@@H]([C@H](O3)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H19N5O7/c1-7(22)18-16-19-13-12(14(20-16)25-4)17-6-21(13)11-5-10(26-8(2)23)15(28-11)27-9(3)24/h6,10-11,15H,5H2,1-4H3,(H,18,19,20,22)/t10-,11+,15-/m0/s1