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Substance Name: 3,3'-Dioctadecyloxacarbocyanine perchlorate
RN: 34157-25-0
InChIKey: OEVDAKNZMXPEBE-UHFFFAOYSA-M

Molecular Formula

  • C51-H83-N2-O2.Cl-O4

Molecular Weight

  • 855.6777
 
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Names and Synonyms

Name of Substance

  • 3,3'-Dioctadecyloxacarbocyanine perchlorate

Synonyms

  • 3,3'-Dioctadecyl-2,2'-oxacyanine perchlorate
  • N,N'-Dioctadecyloxacyanine perchlorate

Systematic Name

  • Benzoxazolium, 3-octadecyl-2-((3-octadecyl-2-benzoxazolinylidene)methyl)-, perchlorate

Registry Numbers

CAS Registry Number

  • 34157-25-0

System Generated Number

  • 0034157250

Molecular Formulas

Molecular Formula

  • C51-H83-N2-O2.Cl-O4

Molecular Formula Fragments

  • C51-H83-N2-O2
  • Cl-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C51H83N2O2.ClHO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-43-52-46-39-33-35-41-48(46)54-50(52)45-51-53(47-40-34-36-42-49(47)55-51)44-38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;2-1(3,4)5/h33-36,39-42,45H,3-32,37-38,43-44H2,1-2H3;(H,2,3,4,5)/q+1;/p-1

InChIKey

OEVDAKNZMXPEBE-UHFFFAOYSA-M

Smiles

[n+]1(c(/C=c2\n(c3c(o2)cccc3)CCCCCCCCCCCCCCCCCC)oc2c1cccc2)CCCCCCCCCCCCCCCCCC.[Cl](=O)(=O)(=O)[O-]