8-Cyclopentyltheophylline
CAS Registry Number®
35873-49-5
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CAS Name
8-CyclopentyltheophyllineMolecular Formula
C12H16N4O2Molecular Mass
248.28Cite this Page
8-Cyclopentyltheophylline. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=35873-49-5 (retrieved ) (CAS RN: 35873-49-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H16N4O2/c1-15-10-8(11(17)16(2)12(15)18)13-9(14-10)7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14)
InChIKey
InChIKey=SCVHFRLUNIOSGI-UHFFFAOYSA-N
SMILES
O=C1C2=C(N=C(N2)C3CCCC3)N(C)C(=O)N1C
Canonical SMILES
O=C1C=2NC(=NC2N(C(=O)N1C)C)C3CCCC3
Other Names for this Substance
- 1H-Purine-2,6-dione, 8-cyclopentyl-3,9-dihydro-1,3-dimethyl-
- 1H-Purine-2,6-dione, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl-
- 8-Cyclopentyl-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione
- 8-Cyclopentyltheophylline
- 8-Cyclopentyl-1,3-dimethylxanthine
