8-cyclopentyloxy-1,3,7-trimethyl-purine-2,6-dione

Molecular Formula: C₁₃H₁₈N₄O₃

InChI: InChI=1/C13H18N4O3/c1-15-9-10(16(2)13(19)17(3)11(9)18)14-12(15)20-8-6-4-5-7-8/h8H,4-7H2,1-3H3

InChIKey: InChIKey=DBMKBAZKDMFYLG-UHFFFAOYAQ
SMILES: CN1C2=C(N=C1OC3CCCC3)N(C(=O)N(C2=O)C)C

Names:
    CAFFEINE, 8-(CYCLOPENTYLOXY)-
    NSC 106196
    1H-Purine-2,6-dione, 8-(cyclopentyloxy)-3,7-dihydro-1,3,7-trimethyl- (9CI)
    73747-33-8
    8-cyclopentyloxy-1,3,7-trimethyl-purine-2,6-dione
    8-(Cyclopentyloxy)caffeine

Registries:
    PubChem CID 52354
    PubChem ID 190375