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Substance Name: Benzothiazolium, 2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-buten-1-yl)-6-methoxy-5-methyl-3-(3-sulfopropyl)-, inner salt
RN: 63815-98-5
InChIKey: RADGWPOXLVXFCP-UHFFFAOYSA-N

Molecular Formula

  • C27-H32-N2-O5-S2-Se

Molecular Weight

  • 607.6508
 
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Names and Synonyms

Synonym

  • Benzothiazolium, 2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-butenyl)-6-methoxy-5-methyl-3-(3-sulfopropyl)-, hydroxide, inner salt

Systematic Names

  • Benzothiazolium, 2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-buten-1-yl)-6-methoxy-5-methyl-3-(3-sulfopropyl)-, inner salt
  • Benzothiazolium, 2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-butenyl)-6-methoxy-5-methyl-3-(3-sulfopropyl)-, inner salt

Registry Numbers

CAS Registry Number

  • 63815-98-5

System Generated Number

  • 0063815985

Structure Descriptors

InChI

1S/C27H32N2O5S2Se/c1-6-19(15-27-28(7-2)22-16-20(33-4)9-10-25(22)37-27)14-26-29(11-8-12-36(30,31)32)21-13-18(3)23(34-5)17-24(21)35-26/h9-10,13-17H,6-8,11-12H2,1-5H3

InChIKey

RADGWPOXLVXFCP-UHFFFAOYSA-N

Smiles

CC/C(=C/c1[n+](c2cc(c(cc2s1)OC)C)CCCS(=O)(=O)[O-])/C=C\3/N(c4cc(ccc4[Se]3)OC)CC