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Substance Name: 7-Anilino-3-((4-((2,4-dimethyl-6-sulphophenyl)azo)-2-methoxy-5-methylphenyl)azo)-4-hydroxynaphthalene-2-sulphonic acid, compound with 2,2'-iminodiethanol (1:2)
RN: 94134-50-6
InChIKey: BZPWQKSMNPIDFH-AVRYKWKFSA-N

Molecular Formula

  • C32-H29-N5-O8-S2.2C4-H11-N-O2

Molecular Weight

  • 886.0119
 
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Names and Synonyms

Synonym

  • EINECS 302-819-1

Systematic Name

  • 7-Anilino-3-((4-((2,4-dimethyl-6-sulphophenyl)azo)-2-methoxy-5-methylphenyl)azo)-4-hydroxynaphthalene-2-sulphonic acid, compound with 2,2'-iminodiethanol (1:2)

Registry Numbers

CAS Registry Number

  • 94134-50-6

System Generated Number

  • 0094134506

Molecular Formulas

Molecular Formula

  • C32-H29-N5-O8-S2.2C4-H11-N-O2

Molecular Formula Fragments

  • C32-H29-N5-O8-S2
  • C4-H11-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C32H29N5O8S2.2C4H11NO2/c1-18-12-20(3)30(28(13-18)46(39,40)41)36-34-25-17-27(45-4)26(14-19(25)2)35-37-31-29(47(42,43)44)16-21-15-23(10-11-24(21)32(31)38)33-22-8-6-5-7-9-22;2*6-3-1-5-2-4-7/h5-17,33,38H,1-4H3,(H,39,40,41)(H,42,43,44);2*5-7H,1-4H2/b36-34+,37-35+;;

InChIKey

BZPWQKSMNPIDFH-AVRYKWKFSA-N

Smiles

N(CCO)CCO.c1c(c(c(c2ccc(cc12)Nc1ccccc1)O)/N=N/c1c(cc(c(c1)C)/N=N/c1c(cc(cc1S(=O)(=O)O)C)C)OC)S(=O)(=O)O.N(CCO)CCO