[3,4-diacetyloxy-5-(6-oxidanylidene-3H-purin-7-yl)oxolan-2-yl]methyl ethanoate

Systemtic Name: [3,4-diacetyloxy-5-(6-oxidanylidene-3H-purin-7-yl)oxolan-2-yl]methyl ethanoate Openeye Name: [3,4-diacetoxy-5-(6-oxo-3H-purin-7-yl)tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3,4-diacetyloxy-5-(6-oxo-3H-purin-7-yl)-2-oxolanyl]methyl ester IUPAC Name: [3,4-diacetyloxy-5-(6-oxo-3H-purin-7-yl)oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3,4-diacetoxy-5-(6-keto-3H-purin-7-yl)tetrahydrofuran-2-yl]methyl ester Formula: C16H18N4O8 MolecularWeight: 394.33612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2C(=O)N=CN3)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2C(=O)N=CN3)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H18N4O8/c1-7(21)25-4-10-12(26-8(2)22)13(27-9(3)23)16(28-10)20-6-19-14-11(20)15(24)18-5-17-14/h5-6,10,12-13,16H,4H2,1-3H3,(H,17,18,24)