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Substance Name: Tropic acid, 4'-bromo-, 3-tropanyl ester
RN: 63978-22-3
InChIKey: HMXQSWAWRXDIOX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H22-Br-N-O3

Molecular Weight

  • 368.269
 
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Names and Synonyms

Synonyms

  • 3-Tropanyl 4'-bromotropate
  • 4'-Bromotropic acid 3-tropanyl ester
  • 5-21-01-00239 (Beilstein Handbook Reference)
  • BRN 1548279

Systematic Name

  • Tropic acid, 4'-bromo-, 3-tropanyl ester

Registry Numbers

CAS Registry Number

  • 63978-22-3

System Generated Number

  • 0063978223

Structure Descriptors

InChI

1S/C17H22BrNO3/c1-19-13-6-7-14(19)9-15(8-13)22-17(21)16(10-20)11-2-4-12(18)5-3-11/h2-5,13-16,20H,6-10H2,1H3

InChIKey

HMXQSWAWRXDIOX-UHFFFAOYSA-N

Smiles

N1([C@@H]2CC(C[C@@H]1CC2)OC([C@@H](c1ccc(cc1)Br)CO)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 1024mg/kg (1024mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 477, 1969.