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Substance Name: Theodrenaline hydrochloride
RN: 2572-61-4
UNII: 770L7172BR
InChIKey: CSKCJAUXLOQTMM-UHFFFAOYSA-N

Molecular Formula

  • C17-H21-N5-O5.Cl-H

Molecular Weight

  • 411.8438
 
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Names and Synonyms

Name of Substance

  • Theodrenaline hydrochloride

Synonyms

  • EINECS 219-920-0
  • UNII-770L7172BR

Systematic Name

  • 7-(2-((2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl)amino)ethyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride

Registry Numbers

CAS Registry Number

  • 2572-61-4

FDA UNII

  • 770L7172BR

System Generated Number

  • 0002572614

Molecular Formulas

Molecular Formula

  • C17-H21-N5-O5.Cl-H

Molecular Formula Fragments

  • C17-H21-N5-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/C17H21N5O5.ClH/c1-20-15-14(16(26)21(2)17(20)27)22(9-19-15)6-5-18-8-13(25)10-3-4-11(23)12(24)7-10;/h3-4,7,9,13,18,23-25H,5-6,8H2,1-2H3;1H

InChIKey

CSKCJAUXLOQTMM-UHFFFAOYSA-N

Smiles

Cl.CN1C(=O)N(C)c2ncn(CCNCC(O)c3ccc(O)c(O)c3)c2C1=O