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Substance Name: Glycine, N,N'-((3-oxo-1(3H)-isobenzofuranylidene)bis((6-hydroxy-3,1-phenylene)methylene))bis(N-(carboxymethyl)-, sodium salt (1:4)
RN: 62698-58-2
InChIKey: QUTZXSTYIVWJQG-UHFFFAOYSA-J

Molecular Formula

  • C30-H28-N2-O12.4Na

Molecular Weight

  • 696.482
 
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Names and Synonyms

Synonym

  • NSC 270079

Systematic Names

  • Glycine, N,N'-((3-oxo-1(3H)-isobenzofuranylidene)bis((6-hydroxy-3,1-phenylene)methylene))bis(N-(carboxymethyl)-, sodium salt (1:4)
  • Glycine, N,N'-((3-oxo-1(3H)-isobenzofuranylidene)bis((6-hydroxy-3,1-phenylene)methylene))bis(N-(carboxymethyl)-, tetrasodium salt

Registry Numbers

CAS Registry Number

  • 62698-58-2

Related Registry Number

  • 25296-54-2 (Parent)

System Generated Number

  • 0062698582

Molecular Formulas

Molecular Formula

  • C30-H28-N2-O12.4Na

Molecular Formula Fragments

  • C30-H28-N2-O12
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C30H28N2O12.4Na/c33-23-7-5-19(9-17(23)11-31(13-25(35)36)14-26(37)38)30(22-4-2-1-3-21(22)29(43)44-30)20-6-8-24(34)18(10-20)12-32(15-27(39)40)16-28(41)42;;;;/h1-10,33-34H,11-16H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42);;;;/q;4*+1/p-4

InChIKey

QUTZXSTYIVWJQG-UHFFFAOYSA-J

Smiles

c12C(=O)OC(c3cc(CN(CC(=O)[O-])CC(=O)[O-])c(O)cc3)(c3cc(CN(CC(=O)[O-])CC(=O)[O-])c(O)cc3)c1cccc2.[Na+].[Na+].[Na+].[Na+]