3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl methanesulfonate

Systemtic Name: 3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl methanesulfonate Openeye Name: [1-methyl-2-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]octyl] methanesulfonate CAS Name: methanesulfonic acid 3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl ester IUPAC Name: 3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl methanesulfonate Traditional Name: methanesulfonic acid [2-[6-keto-2-(2-propoxyphenyl)-3H-purin-9-yl]-1-methyl-octyl] ester Formula: C24H34N4O5S MolecularWeight: 490.61556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)OS(=O)(=O)C)N1C=NC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC

Isomeric SMILES

CCCCCCC(C(C)OS(=O)(=O)C)N1C=NC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC

InChI

InChI=1S/C24H34N4O5S/c1-5-7-8-9-13-19(17(3)33-34(4,30)31)28-16-25-21-23(28)26-22(27-24(21)29)18-12-10-11-14-20(18)32-15-6-2/h10-12,14,16-17,19H,5-9,13,15H2,1-4H3,(H,26,27,29)