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Substance Name: 5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium hydrogen sulphate
RN: 85283-78-9
InChIKey: NJPNVCQLPSZMHN-UHFFFAOYSA-M

Molecular Formula

  • C29-H29-N2-O.H-O4-S

Molecular Weight

  • 518.631
 
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Names and Synonyms

Synonym

  • EINECS 286-605-2

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 85283-78-9

System Generated Number

  • 0085283789

Molecular Formulas

Molecular Formula

  • C29-H29-N2-O.H-O4-S

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C29H29N2O.H2O4S/c1-29(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/h6-19H,1-5H3;(H2,1,2,3,4)/q+1;/p-1

InChIKey

NJPNVCQLPSZMHN-UHFFFAOYSA-M

Smiles

CC1(c2cc(ccc2[N+](=C1/C=C/c3c4ccccc4n(c3c5ccccc5)C)C)OC)C.OS(=O)(=O)[O-]