Theophylline, 8-chloro-7-hydroxymethyl-, nitrate (ester)
Molecular Formula:
C8H10ClN5O6
InChI: InChI=1/C8H9ClN4O3.HNO3/c1-11-5-4(6(15)12(2)8(11)16)13(3-14)7(9)10-5;2-1(3)4/h14H,3H2,1-2H3;(H,2,3,4)/f/h;2H
InChIKey: InChIKey=AKWIIELWJKTVGQ-BAUHCGJDCX
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CO.[N+](=O)(O)[O-]
Names:
Nitric acid, ester with 8-chloro-1,3-dimethyl-7-hydroxymethylxanthine
Theophylline, 8-chloro-7-hydroxymethyl-, nitrate (ester)
Theophylline, 8-chloro-7-hydroxymethyl-, nitrate
Theophylline, 8-chloro-7-hydroxymethyl-, nitrate (ester)
Xanthine, 8-chloro-1,3-dimethyl-7-hydroxymethyl-, nitrate (ester)
63906-66-1
8-Chloro-7-hydroxycaffeine nitrate
8-chloro-7-(hydroxymethyl)-1,3-dimethyl-purine-2,6-dione; nitric acid
Registries:
PubChem CID 64130
PubChem ID 206173
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