Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Theophylline-7-acetylaminobutanol
RN: 82951-56-2
InChIKey: RAJOZBBPJBDOMX-UHFFFAOYSA-N

Molecular Weight

  • 309.3241
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Theophylline-7-acetylaminobutanol

Synonym

  • 2-N-(Theophyllinyl-7-acetyl)aminobutanol

Systematic Name

  • 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-N-(1-(hydroxymethyl)propyl)-1,3-dimethyl-2,6-dioxo-

Registry Numbers

CAS Registry Number

  • 82951-56-2

System Generated Number

  • 0082951562

Structure Descriptors

InChI

1S/C13H19N5O4/c1-4-8(6-19)15-9(20)5-18-7-14-11-10(18)12(21)17(3)13(22)16(11)2/h7-8,19H,4-6H2,1-3H3,(H,15,20)

InChIKey

RAJOZBBPJBDOMX-UHFFFAOYSA-N

Smiles

CCC(CO)NC(=O)Cn1cnc2N(C)C(=O)N(C)C(=O)c12