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Substance Name: Disodium (4-amino-5-hydroxy-6-((2-hydroxy-5-nitrophenyl)azo)naphthalene-1,7-disulphonato(4-))(2-((2-hydroxy-5-sulphamoylphenyl)azo)-3-oxo-N-phenylbutyramidato)chromate(2-)
RN: 94233-12-2
InChIKey: MRHPUCVUEXPNRN-AFYCLPRDSA-I

Molecular Formula

  • C32-H23-Cr-N8-O15-S3.2Na

Molecular Weight

  • 953.7487
 
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Names and Synonyms

Synonym

  • EINECS 304-042-3

Systematic Name

  • Disodium (4-amino-5-hydroxy-6-((2-hydroxy-5-nitrophenyl)azo)naphthalene-1,7-disulphonato(4-))(2-((2-hydroxy-5-sulphamoylphenyl)azo)-3-oxo-N-phenylbutyramidato)chromate(2-)

Registry Numbers

CAS Registry Number

  • 94233-12-2

System Generated Number

  • 0094233122

Molecular Formulas

Molecular Formula

  • C32-H23-Cr-N8-O15-S3.2Na

Molecular Formula Fragments

  • C32-H23-Cr-N8-O15-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H12N4O10S2.C16H16N4O5S.Cr.2Na/c17-9-2-4-12(31(25,26)27)8-6-13(32(28,29)30)15(16(22)14(8)9)19-18-10-5-7(20(23)24)1-3-11(10)21;1-10(21)15(16(23)18-11-5-3-2-4-6-11)20-19-13-9-12(26(17,24)25)7-8-14(13)22;;;/h1-6,21-22H,17H2,(H,25,26,27)(H,28,29,30);2-9,15,22H,1H3,(H,18,23)(H2,17,24,25);;;/q;;+3;2*+1/p-5/b19-18+;20-19+;;;

InChIKey

MRHPUCVUEXPNRN-AFYCLPRDSA-I

Smiles

CC(=O)C(C(=O)Nc1ccccc1)/N=N/c2cc(ccc2O[Cr-2]345Oc6ccc(cc6/N=N/c7c(cc8c(ccc(c8c7O3)N)S(=O)(=O)O4)S(=O)(=O)O5)[N+](=O)[O-])S(=O)(=O)N.[Na+].[Na+]