[9-(phenylmethyl)purin-6-yl]methyl methanesulfonate

Systemtic Name: [9-(phenylmethyl)purin-6-yl]methyl methanesulfonate Openeye Name: (9-benzylpurin-6-yl)methyl methanesulfonate CAS Name: methanesulfonic acid [9-(phenylmethyl)-6-purinyl]methyl ester IUPAC Name: (9-benzylpurin-6-yl)methyl methanesulfonate Traditional Name: methanesulfonic acid (9-benzylpurin-6-yl)methyl ester Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=C2C(=NC=N1)N(C=N2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OCC1=C2C(=NC=N1)N(C=N2)CC3=CC=CC=C3

InChI

InChI=1S/C14H14N4O3S/c1-22(19,20)21-8-12-13-14(16-9-15-12)18(10-17-13)7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3