3-Pyridinecarboxylic acid, compd. with 3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)
CAS Registry Number®
32059-19-1
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CAS Name
3-Pyridinecarboxylic acid, compd. with 3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)Molecular Formula
C7H8N4O2.C6H5NO2Cite this Page
3-Pyridinecarboxylic acid, compd. with 3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=32059-19-1 (retrieved ) (CAS RN: 32059-19-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C7H8N4O2.C6H5NO2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;8-6(9)5-2-1-3-7-4-5/h3H,1-2H3,(H,8,9);1-4H,(H,8,9)
InChIKey
InChIKey=FWZBHOANBPBKHU-UHFFFAOYSA-N
SMILES
C(O)(=O)C=1C=CC=NC1.O=C1C2=C(N(C)C(=O)N1C)N=CN2
Canonical SMILES
O=C(O)C=1C=NC=CC1.O=C1C=2NC=NC2N(C(=O)N1C)C
Other Names for this Substance
- 3-Pyridinecarboxylic acid, compd. with 3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)
- Nicotinic acid, compd. with theophylline (1:1)
- Theophylline nicotinate
- NSC 142642
