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Substance Name: Bromadoline maleate [USAN]
RN: 81447-81-6
UNII: 0NLD148UB3
InChIKey: XHCXKGFNPZETQY-YHPCKPBFSA-N

Classification Code

  • Analgesic

Molecular Formula

  • C15-H21-Br-N2-O.C4-H4-O4

Molecular Weight

  • 441.319
 
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Names and Synonyms

Name of Substance

  • Bromadoline maleate [USAN]

Synonyms

  • Benzamide, 4-bromo-N-(2-(dimethylamino)cyclohexyl)-, trans-, (Z)-2-butenedioate (1:1)
  • Bromadoline maleate
  • trans-p-Bromo-N-(2-(dimethylamino)cyclohexyl)benzamide maleate (1:1)
  • U 47,931E
  • U-47,931E
  • UNII-0NLD148UB3

Systematic Name

  • Benzamide, 4-bromo-N-(2-(dimethylamino)cyclohexyl)-, trans-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 81447-81-6

FDA UNII

  • 0NLD148UB3

Related Registry Number

  • 67579-24-2 (Parent)

System Generated Number

  • 0081447816

Molecular Formulas

Molecular Formula

  • C15-H21-Br-N2-O.C4-H4-O4

Molecular Formula Fragments

  • C15-H21-Br-N2-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C15H21BrN2O.C4H4O4/c1-18(2)14-6-4-3-5-13(14)17-15(19)11-7-9-12(16)10-8-11;5-3(6)1-2-4(7)8/h7-10,13-14H,3-6H2,1-2H3,(H,17,19);1-2H,(H,5,6)(H,7,8)/b;2-1-/t13-,14-;/m0./s1

InChIKey

XHCXKGFNPZETQY-YHPCKPBFSA-N

Smiles

N([C@@H]1[C@H](CCCC1)N(C)C)C(c1ccc(cc1)Br)=O.C(=C/C(=O)O)\C(=O)O