[3,4-diacetyloxy-5-(6-chloranylpurin-1-yl)oxolan-2-yl]methyl ethanoate

Systemtic Name: [3,4-diacetyloxy-5-(6-chloranylpurin-1-yl)oxolan-2-yl]methyl ethanoate Openeye Name: [3,4-diacetoxy-5-(6-chloropurin-1-yl)tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3,4-diacetyloxy-5-(6-chloro-1-purinyl)-2-oxolanyl]methyl ester IUPAC Name: [3,4-diacetyloxy-5-(6-chloropurin-1-yl)oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3,4-diacetoxy-5-(6-chloropurin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C16H17ClN4O7 MolecularWeight: 412.78178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=NC=NC3=C2Cl)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(O1)N2C=NC3=NC=NC3=C2Cl)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H17ClN4O7/c1-7(22)25-4-10-12(26-8(2)23)13(27-9(3)24)16(28-10)21-6-20-15-11(14(21)17)18-5-19-15/h5-6,10,12-13,16H,4H2,1-3H3