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Substance Name: Bis((4-((4-(bis(2-hydroxyethyl)amino)-o-tolyl)(4-(dimethylamino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)dimethylammonium) sulphate
RN: 83950-36-1
InChIKey: VSKMATUHECNSID-RCVLWEDESA-L

Molecular Formula

  • C28-H36-N3-O2.1/2O4-S

Molecular Weight

  • 1023.3462
 
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Names and Synonyms

Synonym

  • EINECS 281-486-3

Systematic Name

  • Bis((4-((4-(bis(2-hydroxyethyl)amino)-o-tolyl)(4-(dimethylamino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)dimethylammonium) sulphate

Registry Numbers

CAS Registry Number

  • 83950-36-1

System Generated Number

  • 0083950361

Molecular Formulas

Molecular Formula

  • C28-H36-N3-O2.1/2O4-S

Molecular Formula Fragments

  • C28-H36-N3-O2
  • COMPONENT
  • O4-S

Structure Descriptors

InChI

1S/2C28H39N4O2.H2O4S/c2*1-5-28(21-29)14-12-25(13-15-28)32(24-8-6-23(7-9-24)30(3)4)27-11-10-26(20-22(27)2)31(16-18-33)17-19-34;1-5(2,3)4/h2*6-15,20,33-34H,5,16-19,21,29H2,1-4H3;(H2,1,2,3,4)/q2*+1;/p-2/b2*32-25-;

InChIKey

VSKMATUHECNSID-RCVLWEDESA-L

Smiles

CCC1(C=CC(=[N+](c2ccc(cc2)N(C)C)c3ccc(cc3C)N(CCO)CCO)C=C1)CN.CCC1(C=CC(=[N+](c2ccc(cc2)N(C)C)c3ccc(cc3C)N(CCO)CCO)C=C1)CN.[O-]S(=O)(=O)[O-]