Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium sulphate (2:1)
RN: 85283-79-0
InChIKey: NIUGKBGUKZLVDF-UHFFFAOYSA-L

Molecular Formula

  • C29-H29-N2-O.1/2O4-S

Molecular Weight

  • 939.1842
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 286-606-8

Systematic Name

  • 5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium sulphate (2:1)

Registry Numbers

CAS Registry Number

  • 85283-79-0

System Generated Number

  • 0085283790

Molecular Formulas

Molecular Formula

  • C29-H29-N2-O.1/2O4-S

Molecular Formula Fragments

  • C29-H29-N2-O
  • COMPONENT
  • O4-S

Structure Descriptors

InChI

1S/2C29H29N2O.H2O4S/c2*1-29(2)24-19-21(32-5)15-17-26(24)30(3)27(29)18-16-23-22-13-9-10-14-25(22)31(4)28(23)20-11-7-6-8-12-20;1-5(2,3)4/h2*6-19H,1-5H3;(H2,1,2,3,4)/q2*+1;/p-2

InChIKey

NIUGKBGUKZLVDF-UHFFFAOYSA-L

Smiles

CC1(C(=[N+](c2c1cc(cc2)OC)C)/C=C/c3c(n(c4c3cccc4)C)c5ccccc5)C.CC1(C(=[N+](c2c1cc(cc2)OC)C)/C=C/c3c(n(c4c3cccc4)C)c5ccccc5)C.[O-]S(=O)(=O)[O-]