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Substance Name: EINECS 305-248-6
RN: 94386-25-1
InChIKey: GVCKRNAGXPCVBW-INXAVRNWSA-J

Molecular Formula

  • C36-H28-N10-O15-S4.4Li

Molecular Weight

  • 992.6686
 
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Names and Synonyms

Results Name

  • EINECS 305-248-6

Synonym

  • EINECS 305-248-6

Systematic Name

  • Tetralithium 4-amino-6-((4-(2-(4-((2,4-diaminophenyl)azo)-2-sulphonatophenyl)vinyl)-3-sulphonatophenyl)azo)-5-hydroxy-3-((4-nitrophenyl)azo)naphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 94386-25-1

System Generated Number

  • 0094386251

Molecular Formulas

Molecular Formula

  • C36-H28-N10-O15-S4.4Li

Molecular Formula Fragments

  • C36-H28-N10-O15-S4
  • COMPONENT
  • Li

Structure Descriptors

InChI

1S/C36H28N10O15S4.4Li/c37-21-5-12-27(26(38)15-21)43-41-23-6-3-18(28(16-23)62(50,51)52)1-2-19-4-7-24(17-29(19)63(53,54)55)42-45-35-31(65(59,60)61)14-20-13-30(64(56,57)58)34(33(39)32(20)36(35)47)44-40-22-8-10-25(11-9-22)46(48)49;;;;/h1-17,47H,37-39H2,(H,50,51,52)(H,53,54,55)(H,56,57,58)(H,59,60,61);;;;/q;4*+1/p-4/b2-1+,43-41+,44-40+,45-42+;;;;

InChIKey

GVCKRNAGXPCVBW-INXAVRNWSA-J

Smiles

[Li+].[Li+].[Li+].[Li+].c1cc(ccc1/N=N/c2c(cc3cc(c(c(c3c2N)O)/N=N/c4ccc(c(c4)S(=O)(=O)[O-])/C=C/c5ccc(cc5S(=O)(=O)[O-])/N=N/c6ccc(cc6N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-]