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Substance Name: Org 7684
RN: 104884-91-5
InChIKey: AEIJWTZQBCTTFW-YLWCDYKMSA-M

Molecular Formula

  • C34-H57-N2-O2.Br

Molecular Weight

  • 605.74
 
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Names and Synonyms

Name of Substance

  • Org 7684

Synonym

  • Org-7684

Systematic Name

  • Piperidinium, 1-((2beta,3alpha,5alpha,16beta)-3-(acetyloxy)-2-(1-piperidinyl)androstan-16-yl)-1-(2-propenyl)-, bromide

Registry Numbers

CAS Registry Number

  • 104884-91-5

System Generated Number

  • 0104884915

Molecular Formulas

Molecular Formula

  • C34-H57-N2-O2.Br

Molecular Formula Fragments

  • Br
  • C34-H57-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C34H57N2O2.BrH/c1-5-18-36(19-10-7-11-20-36)27-22-30-28-13-12-26-21-32(38-25(2)37)31(35-16-8-6-9-17-35)24-34(26,4)29(28)14-15-33(30,3)23-27;/h5,26-32H,1,6-24H2,2-4H3;1H/q+1;/p-1/t26-,27-,28?,29?,30?,31-,32-,33+,34-;/m0./s1

InChIKey

AEIJWTZQBCTTFW-YLWCDYKMSA-M

Smiles

[N+]1(CCCCC1)(CC=C)[C@H]1C[C@@H]2[C@@H]3CC[C@H]4C[C@@H]([C@H](C[C@@]4([C@@H]3CC[C@@]2(C1)C)C)N1CCCCC1)OC(=O)C.[BrH-]