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Substance Name: Sodium-binding benzofuran isophthalate
RN: 124549-08-2
InChIKey: UGJCNRLBGKEGEH-UHFFFAOYSA-N

Classification Codes

  • Coloring Agents
  • Fluorescent Dyes
  • Indicators and Reagents
  • Luminescent Agents

Molecular Formula

  • C44-H42-N2-O15

Molecular Weight

  • 838.815
 
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Names and Synonyms

Name of Substance

  • Sodium-binding benzofuran isophthalate

Synonyms

  • SBFI
  • Sodium benzofuran isophthalate

Systematic Name

  • 1,3-Benzenedicarboxylic acid, 4,4'-(1,4,10-trioxa-7,13-diazacyclopentadecane-7,13-diylbis(5-methoxy-6,2-benzofurandiyl))bis-

Registry Numbers

CAS Registry Number

  • 124549-08-2

System Generated Number

  • 0124549082

Structure Descriptors

InChI

1S/C44H42N2O15/c1-55-39-21-27-19-37(29-5-3-25(41(47)48)17-31(29)43(51)52)60-35(27)23-33(39)45-7-11-57-12-8-46(10-14-59-16-15-58-13-9-45)34-24-36-28(22-40(34)56-2)20-38(61-36)30-6-4-26(42(49)50)18-32(30)44(53)54/h3-6,17-24H,7-16H2,1-2H3,(H,47,48)(H,49,50)(H,51,52)(H,53,54)

InChIKey

UGJCNRLBGKEGEH-UHFFFAOYSA-N

Smiles

c1(oc2cc(N3CCOCCN(c4cc5oc(c6c(cc(cc6)C(=O)O)C(=O)O)cc5cc4OC)CCOCCOCC3)c(cc2c1)OC)c1c(cc(cc1)C(=O)O)C(=O)O