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Substance Name: Acridine, 9,9'-heptamethylenedioxybis(o-phenyleneimino)bis-, dihydrochloride
RN: 66724-91-2
InChIKey: KEGAPPZJBCHCOU-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C45-H40-N4-O2.2Cl-H

Molecular Weight

  • 741.759
 
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Names and Synonyms

Synonym

  • 9,9'-Heptamethylenedioxybis(o-phenyleneimino)bisacridine dihydrochloride

Systematic Name

  • Acridine, 9,9'-heptamethylenedioxybis(o-phenyleneimino)bis-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 66724-91-2

System Generated Number

  • 0066724912

Molecular Formulas

Molecular Formula

  • C45-H40-N4-O2.2Cl-H

Molecular Formula Fragments

  • C45-H40-N4-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C45H40N4O2.2ClH/c1(2-16-30-50-42-28-14-12-26-40(42)48-44-32-18-4-8-22-36(32)46-37-23-9-5-19-33(37)44)3-17-31-51-43-29-15-13-27-41(43)49-45-34-20-6-10-24-38(34)47-39-25-11-7-21-35(39)45;;/h4-15,18-29H,1-3,16-17,30-31H2,(H,46,48)(H,47,49);2*1H

InChIKey

KEGAPPZJBCHCOU-UHFFFAOYSA-N

Smiles

c1(c2c(nc3c1cccc3)cccc2)[NH+]c1c(cccc1)OCCCCCCCOc1c([NH+]c2c3c(nc4c2cccc4)cccc3)cccc1.[ClH-].[ClH-]