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Substance Name: N-Octylatropinium
RN: 83173-57-3
UNII: W7SXP8F329
InChIKey: XQIDVDQPJDMFHO-BWKOSVORSA-N

Molecular Weight

  • 402.595
 
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Names and Synonyms

Name of Substance

  • N-Octylatropinium

Synonyms

  • (+/-)-N-Octylatropinium
  • 8-Azoniabicyclo(3.2.1)octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8-methyl-8-octyl-, (3-endo)-
  • N-Octylatropinium
  • N-Octylatropinium cation
  • N-Octylatropinium ion
  • Octylatropine
  • UNII-W7SXP8F329

Registry Numbers

CAS Registry Number

  • 83173-57-3

FDA UNII

  • W7SXP8F329

System Generated Number

  • 0083173573

Structure Descriptors

InChI

1S/C25H40NO3/c1-3-4-5-6-7-11-16-26(2)21-14-15-22(26)18-23(17-21)29-25(28)24(19-27)20-12-9-8-10-13-20/h8-10,12-13,21-24,27H,3-7,11,14-19H2,1-2H3/q+1/t21-,22+,23+,24?,26?

InChIKey

XQIDVDQPJDMFHO-BWKOSVORSA-N

Smiles

CCCCCCCC[N+]1([C@@H]2CC[C@H]1C[C@H](C2)OC(=O)C(CO)c3ccccc3)C