[5-(6-methoxypurin-9-yl)-3,4-bis(methylsulfonyloxy)oxolan-2-yl]methyl methanesulfonate

Systemtic Name: [5-(6-methoxypurin-9-yl)-3,4-bis(methylsulfonyloxy)oxolan-2-yl]methyl methanesulfonate Openeye Name: [5-(6-methoxypurin-9-yl)-3,4-bis(methylsulfonyloxy)tetrahydrofuran-2-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [5-(6-methoxy-9-purinyl)-3,4-bis(methylsulfonyloxy)-2-oxolanyl]methyl ester IUPAC Name: [5-(6-methoxypurin-9-yl)-3,4-bis(methylsulfonyloxy)oxolan-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-(6-methoxypurin-9-yl)-3,4-bis(methylsulfonyloxy)tetrahydrofuran-2-yl]methyl ester Formula: C14H20N4O11S3 MolecularWeight: 516.5238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC2=C1N=CN2C3C(C(C(O3)COS(=O)(=O)C)OS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

COC1=NC=NC2=C1N=CN2C3C(C(C(O3)COS(=O)(=O)C)OS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C14H20N4O11S3/c1-25-13-9-12(15-6-16-13)18(7-17-9)14-11(29-32(4,23)24)10(28-31(3,21)22)8(27-14)5-26-30(2,19)20/h6-8,10-11,14H,5H2,1-4H3