1,3,7-trimethyl-8-(4-methylcyclohexyl)oxy-purine-2,6-dione

Molecular Formula: C₁₅H₂₂N₄O₃

InChI: InChI=1/C15H22N4O3/c1-9-5-7-10(8-6-9)22-14-16-12-11(17(14)2)13(20)19(4)15(21)18(12)3/h9-10H,5-8H2,1-4H3

InChIKey: InChIKey=CTXYKWGQHYADKR-UHFFFAOYAE
SMILES: CC1CCC(CC1)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

Names:
    CAFFEINE, 8-((cis-4-METHYLCYCLOHEXYL)OXY)-
    NSC 106202
    1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-((4-methylcyclohexyl)oxy)-, cis- (9CI)
    1,3,7-trimethyl-8-(4-methylcyclohexyl)oxy-purine-2,6-dione
    73747-37-2
    8-((cis-4-Methylcyclohexyl)oxy)caffeine

Registries:
    PubChem CID 52358
    PubChem ID 190379