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Substance Name: 3-((4-((6-Amino-1-hydroxy-3-sulpho-2-naphthyl)azo)-5-methoxy-o-tolyl)azo)naphthalene-1,5-disulphonic acid, lithium salt, compound with 2,2',2''-nitrilotriethanol
RN: 68132-89-8
InChIKey: FBXLJMCAVLWXDC-MYYXEQMMSA-N

Molecular Formula

  • C28-H23-N5-O11-S3.x-C6-H15-N-O3.x-Li

Molecular Weight

  • 857.8412
 
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Names and Synonyms

Synonym

  • EINECS 268-653-6

Systematic Name

  • 3-((4-((6-Amino-1-hydroxy-3-sulpho-2-naphthyl)azo)-5-methoxy-o-tolyl)azo)naphthalene-1,5-disulphonic acid, lithium salt, compound with 2,2',2''-nitrilotriethanol

Registry Numbers

CAS Registry Number

  • 68132-89-8

System Generated Number

  • 0068132898

Molecular Formulas

Molecular Formula

  • C28-H23-N5-O11-S3.x-C6-H15-N-O3.x-Li

Molecular Formula Fragments

  • C28-H23-N5-O11-S3
  • C6-H15-N-O3
  • COMPONENT
  • Li

Structure Descriptors

InChI

1S/C28H23N5O11S3.C6H15NO3.Li/c1-14-8-22(32-33-27-26(47(41,42)43)10-15-9-16(29)6-7-18(15)28(27)34)23(44-2)13-21(14)31-30-17-11-20-19(25(12-17)46(38,39)40)4-3-5-24(20)45(35,36)37;8-4-1-7(2-5-9)3-6-10;/h3-13,34H,29H2,1-2H3,(H,35,36,37)(H,38,39,40)(H,41,42,43);8-10H,1-6H2;/q;;+1/b31-30+,33-32+;;

InChIKey

FBXLJMCAVLWXDC-MYYXEQMMSA-N

Smiles

[Li+].Cc1cc(c(cc1/N=N/c2cc3c(cccc3S(=O)(=O)O)c(c2)S(=O)(=O)O)OC)/N=N/c4c(cc5cc(ccc5c4O)N)S(=O)(=O)O.C(CO)N(CCO)CCO