3-butyl-1-methyl-7-[5-methyl-3,4-bis(oxidanyl)oxolan-2-yl]purine-2,6-dione

Systemtic Name: 3-butyl-1-methyl-7-[5-methyl-3,4-bis(oxidanyl)oxolan-2-yl]purine-2,6-dione Openeye Name: 3-butyl-7-(3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl)-1-methyl-purine-2,6-dione CAS Name: 3-butyl-7-(3,4-dihydroxy-5-methyl-2-oxolanyl)-1-methylpurine-2,6-dione IUPAC Name: 3-butyl-7-(3,4-dihydroxy-5-methyloxolan-2-yl)-1-methylpurine-2,6-dione Traditional Name: 3-butyl-7-(3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl)-1-methyl-xanthine Formula: C15H22N4O5 MolecularWeight: 338.35898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)C)N(C=N2)C3C(C(C(O3)C)O)O

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)C)N(C=N2)C3C(C(C(O3)C)O)O

InChI

InChI=1S/C15H22N4O5/c1-4-5-6-18-12-9(13(22)17(3)15(18)23)19(7-16-12)14-11(21)10(20)8(2)24-14/h7-8,10-11,14,20-21H,4-6H2,1-3H3