[9-(oxan-2-yl)purin-6-yl]methyl methanesulfonate

Systemtic Name: [9-(oxan-2-yl)purin-6-yl]methyl methanesulfonate Openeye Name: (9-tetrahydropyran-2-ylpurin-6-yl)methyl methanesulfonate CAS Name: methanesulfonic acid [9-(2-oxanyl)-6-purinyl]methyl ester IUPAC Name: [9-(oxan-2-yl)purin-6-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid (9-tetrahydropyran-2-ylpurin-6-yl)methyl ester Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=C2C(=NC=N1)N(C=N2)C3CCCCO3

Isomeric SMILES

CS(=O)(=O)OCC1=C2C(=NC=N1)N(C=N2)C3CCCCO3

InChI

InChI=1S/C12H16N4O4S/c1-21(17,18)20-6-9-11-12(14-7-13-9)16(8-15-11)10-4-2-3-5-19-10/h7-8,10H,2-6H2,1H3