[(2R,3R,4R,5R)-3-acetyloxy-5-(6-benzamidopurin-9-yl)-4-methoxy-oxolan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4R,5R)-3-acetyloxy-5-(6-benzamidopurin-9-yl)-4-methoxy-oxolan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4R,5R)-3-acetoxy-5-(6-benzamidopurin-9-yl)-4-methoxy-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4R,5R)-3-acetyloxy-5-(6-benzamido-9-purinyl)-4-methoxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,4R,5R)-3-acetyloxy-5-(6-benzamidopurin-9-yl)-4-methoxyoxolan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4R,5R)-3-acetoxy-5-(6-benzamidopurin-9-yl)-4-methoxy-tetrahydrofuran-2-yl]methyl ester Formula: C22H23N5O7 MolecularWeight: 469.44732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)OC)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)OC)OC(=O)C

InChI

InChI=1S/C22H23N5O7/c1-12(28)32-9-15-17(33-13(2)29)18(31-3)22(34-15)27-11-25-16-19(23-10-24-20(16)27)26-21(30)14-7-5-4-6-8-14/h4-8,10-11,15,17-18,22H,9H2,1-3H3,(H,23,24,26,30)/t15-,17-,18-,22-/m1/s1