1-[4,5-bis(oxidanyl)hexyl]-3,7-diethyl-purine-2,6-dione

Systemtic Name: 1-[4,5-bis(oxidanyl)hexyl]-3,7-diethyl-purine-2,6-dione Openeye Name: 1-(4,5-dihydroxyhexyl)-3,7-diethyl-purine-2,6-dione CAS Name: 1-(4,5-dihydroxyhexyl)-3,7-diethylpurine-2,6-dione IUPAC Name: 1-(4,5-dihydroxyhexyl)-3,7-diethylpurine-2,6-dione Traditional Name: 1-(4,5-dihydroxyhexyl)-3,7-diethyl-xanthine Formula: C15H24N4O4 MolecularWeight: 324.37546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2CC)CCCC(C(C)O)O

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2CC)CCCC(C(C)O)O

InChI

InChI=1S/C15H24N4O4/c1-4-17-9-16-13-12(17)14(22)19(15(23)18(13)5-2)8-6-7-11(21)10(3)20/h9-11,20-21H,4-8H2,1-3H3