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Substance Name: Hedaquinium
RN: 687601-03-2
UNII: 58VJ03097A
InChIKey: BKNJRWQHBQLPAQ-UHFFFAOYSA-N

Molecular Formula

  • C34-H46-N2

Molecular Weight

  • 482.7514
 
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Names and Synonyms

Name of Substance

  • Hedaquinium

Synonyms

  • Hedaquinium
  • Hedaquinium cation
  • Hedaquinium ion
  • Isoquinolinium, 2,2'-(1,16-hexadecanediyl)bis-
  • UNII-58VJ03097A

Registry Numbers

CAS Registry Number

  • 687601-03-2

FDA UNII

  • 58VJ03097A

System Generated Number

  • 0687601032

Structure Descriptors

InChI

1S/C34H46N2/c1(3-5-7-9-11-17-25-35-27-23-31-19-13-15-21-33(31)29-35)2-4-6-8-10-12-18-26-36-28-24-32-20-14-16-22-34(32)30-36/h13-16,19-24,27-30H,1-12,17-18,25-26H2/q+2

InChIKey

BKNJRWQHBQLPAQ-UHFFFAOYSA-N

Smiles

c1ccc2c[n+](ccc2c1)CCCCCCCCCCCCCCCC[n+]3ccc4ccccc4c3