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Substance Name: EINECS 269-322-9
RN: 68220-31-5
InChIKey: LJGUUQQEDUELFT-UHFFFAOYSA-M

Molecular Formula

  • C43-H53-N2-O4-S2.Cl-O4

Molecular Weight

  • 825.4827
 
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Names and Synonyms

Results Name

  • EINECS 269-322-9

Synonym

  • EINECS 269-322-9

Systematic Names

  • Benzothiazolium, 3-ethyl-2-((3-(3-(3-((3-ethyl-5,6-dimethoxy-2(3H)-benzothiazolylidene)methyl)-5,5-demethyl-2-cyclohexen-1-ylidene)-1-propenyl)-5,5-dimethyl-2-cyclohexen-1-ylidene)methyl)-5,6-dimethoxy-, perchlorate
  • Benzothiazolium, 3-ethyl-2-((3-(3-(3-((3-ethyl-5,6-dimethoxy-2(3H)-benzothiazolylidene)methyl)-5,5-dimethyl-2-cyclohexen-1-ylidene)-1-propenyl)-5,5-dimethyl-2-cyclohexen-1-ylidene)methyl)-5,6-dimethoxy-, perchlorate

Registry Numbers

CAS Registry Number

  • 68220-31-5

System Generated Number

  • 0068220315

Molecular Formulas

Molecular Formula

  • C43-H53-N2-O4-S2.Cl-O4

Molecular Formula Fragments

  • C43-H53-N2-O4-S2
  • Cl-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C43H53N2O4S2.ClHO4/c1-11-44-32-20-34(46-7)36(48-9)22-38(32)50-40(44)18-30-16-28(24-42(3,4)26-30)14-13-15-29-17-31(27-43(5,6)25-29)19-41-45(12-2)33-21-35(47-8)37(49-10)23-39(33)51-41;2-1(3,4)5/h13-23H,11-12,24-27H2,1-10H3;(H,2,3,4,5)/q+1;/p-1

InChIKey

LJGUUQQEDUELFT-UHFFFAOYSA-M

Smiles

CC[n+]1c2cc(c(cc2sc1/C=C/3\CC(CC(=C3)/C=C/C=C/4\CC(CC(=C4)/C=C/5\N(c6cc(c(cc6S5)OC)OC)CC)(C)C)(C)C)OC)OC.[O-]Cl(=O)(=O)=O