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Substance Name: Dolestan
RN: 58748-06-4
InChIKey: HURLKRCVEDTGLA-UHFFFAOYSA-N

Note

  • Contains carbromal, bromisoval, & acecarbromal.

Molecular Formula

  • C17-H21-N-O.C9-H15-Br-N2-O3.C7-H13-Br-N2-O2.C6-H11-Br-N2-O2

Molecular Weight

  • 994.656
 
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Names and Synonyms

Name of Substance

  • Dolestan

Systematic Names

  • Butanamide, N-((acetylamino)carbonyl)-2-bromo-2-ethyl-, mixt with N-(aminocarbonyl)-2-bromo-2-ethylbutanamide, N-(aminocarbonyl)-2-bromo-3-methylbutanamide and 2-(diphenylmethoxy)-N,N-dimethylethanamine
  • Dolestan

Registry Numbers

CAS Registry Number

  • 58748-06-4

Other Registry Number

  • 52232-04-9

System Generated Number

  • 0058748064

Molecular Formulas

Molecular Formula

  • C17-H21-N-O.C9-H15-Br-N2-O3.C7-H13-Br-N2-O2.C6-H11-Br-N2-O2

Molecular Formula Fragments

  • C17-H21-N-O
  • C6-H11-Br-N2-O2
  • C7-H13-Br-N2-O2
  • C9-H15-Br-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C17H21NO.C9H15BrN2O3.C7H13BrN2O2.C6H11BrN2O2/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-4-9(10,5-2)7(14)12-8(15)11-6(3)13;1-3-7(8,4-2)5(11)10-6(9)12;1-3(2)4(7)5(10)9-6(8)11/h3-12,17H,13-14H2,1-2H3;4-5H2,1-3H3,(H2,11,12,13,14,15);3-4H2,1-2H3,(H3,9,10,11,12);3-4H,1-2H3,(H3,8,9,10,11)

InChIKey

HURLKRCVEDTGLA-UHFFFAOYSA-N

Smiles

N(CCOC(c1ccccc1)c1ccccc1)(C)C.C([C@@H](Br)C(C)C)(=O)NC(=O)N.C(C(CC)(CC)Br)(=O)NC(=O)N.C(C(CC)(CC)Br)(=O)NC(=O)NC(=O)C