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Substance Name: Brl 26830A
RN: 87857-42-9
InChIKey: OIZISCUUSLPUEN-LMORPYAASA-N

Classification Codes

  • Adrenergic Agents
  • Adrenergic Agonists
  • Adrenergic beta-Agonists
  • Hypoglycemic Agents
  • Neurotransmitter Agents

Molecular Formula

  • C19-H23-N-O3.1/2C4-H4-O4

Molecular Weight

  • 427.494
 
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Names and Synonyms

Name of Substance

  • Brl 26830A

Synonyms

  • Brl 26830
  • Brl-26830A
  • Methyl 4-(2-((2-hydroxy-2-phenethyl)amino)propyl)benzoate-2-butanedioate

Systematic Name

  • Benzoic acid, 4-(2-((2-hydroxy-2-phenylethyl)amino)propyl)-, methyl ester, (R*,R*)-(+-)-, (E)-2-butenedioate (2:1) (salt)

Registry Numbers

CAS Registry Number

  • 87857-42-9

System Generated Number

  • 0087857429

Molecular Formulas

Molecular Formula

  • C19-H23-N-O3.1/2C4-H4-O4

Molecular Formula Fragments

  • C19-H23-N-O3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H23NO3.C5H6O3/c1-14(20-13-18(21)16-6-4-3-5-7-16)12-15-8-10-17(11-9-15)19(22)23-2;1-4(6)2-3-5(7)8/h3-11,14,18,20-21H,12-13H2,1-2H3;2-3H,1H3,(H,7,8)/b;3-2+/t14-,18+;/m0./s1

InChIKey

OIZISCUUSLPUEN-LMORPYAASA-N

Smiles

C(OC)(c1ccc(C[C@H](C)NC[C@H](c2ccccc2)O)cc1)=O.C(\C=C\C(=O)C)(=O)O