[(2R,3R,4S,5R)-2-(2-acetamido-6-methoxy-purin-9-yl)-4,5-diacetyloxy-oxolan-3-yl] ethanoate

Systemtic Name: [(2R,3R,4S,5R)-2-(2-acetamido-6-methoxy-purin-9-yl)-4,5-diacetyloxy-oxolan-3-yl] ethanoate Openeye Name: [(2R,3R,4S,5R)-2-(2-acetamido-6-methoxy-purin-9-yl)-4,5-diacetoxy-tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(2R,3R,4S,5R)-2-(2-acetamido-6-methoxy-9-purinyl)-4,5-diacetyloxy-3-oxolanyl] ester IUPAC Name: [(2R,3R,4S,5R)-2-(2-acetamido-6-methoxypurin-9-yl)-4,5-diacetyloxyoxolan-3-yl] acetate Traditional Name: acetic acid [(2R,3R,4S,5R)-2-(2-acetamido-6-methoxy-purin-9-yl)-4,5-diacetoxy-tetrahydrofuran-3-yl] ester Formula: C18H21N5O9 MolecularWeight: 451.38744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)OC)N=CN2C3C(C(C(O3)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O9/c1-7(24)20-18-21-14-11(15(22-18)28-5)19-6-23(14)16-12(29-8(2)25)13(30-9(3)26)17(32-16)31-10(4)27/h6,12-13,16-17H,1-5H3,(H,20,21,22,24)/t12-,13+,16-,17+/m1/s1