3-[5,6-bis(oxidanyl)hexyl]-1,7-diethyl-purine-2,6-dione

Systemtic Name: 3-[5,6-bis(oxidanyl)hexyl]-1,7-diethyl-purine-2,6-dione Openeye Name: 3-(5,6-dihydroxyhexyl)-1,7-diethyl-purine-2,6-dione CAS Name: 3-(5,6-dihydroxyhexyl)-1,7-diethylpurine-2,6-dione IUPAC Name: 3-(5,6-dihydroxyhexyl)-1,7-diethylpurine-2,6-dione Traditional Name: 3-(5,6-dihydroxyhexyl)-1,7-diethyl-xanthine Formula: C15H24N4O4 MolecularWeight: 324.37546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2CCCCC(CO)O)CC

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2CCCCC(CO)O)CC

InChI

InChI=1S/C15H24N4O4/c1-3-17-10-16-13-12(17)14(22)18(4-2)15(23)19(13)8-6-5-7-11(21)9-20/h10-11,20-21H,3-9H2,1-2H3