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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(CO)O

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(CO)O

InChI

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