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Substance Name: 2-Anthracenesulfonic acid, 1-amino-4-((3,5-bis(((2-chloroacetyl)amino)methyl)-2,4,6-trimethylphenyl)amino)-9,10-dihydro-9,10-dioxo-, sodium salt (1:1)
RN: 80010-51-1
InChIKey: HVDUMYBPGXAPLG-UHFFFAOYSA-M

Molecular Formula

  • C29-H28-Cl2-N4-O7-S.Na

Molecular Weight

  • 669.515
 
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Names and Synonyms

Synonyms

  • 2-Anthracenesulfonic acid, 1-amino-4-(bis(3,5-(((chloroacetyl)amino)methyl)-2,4,6-trimethylphenyl)amino)-9,10-dihydro-9,10-dioxo-, monosodium salt
  • EINECS 279-365-5

Systematic Names

  • 2-Anthracenesulfonic acid, 1-amino-4-((3,5-bis(((2-chloroacetyl)amino)methyl)-2,4,6-trimethylphenyl)amino)-9,10-dihydro-9,10-dioxo-, sodium salt (1:1)
  • 2-Anthracenesulfonic acid, 1-amino-4-((3,5-bis(((chloroacetyl)amino)methyl)-2,4,6-trimethylphenyl)amino)-9,10-dihydro-9,10-dioxo-, monosodium salt
  • Sodium 1-amino-4-((3,5-bis(((chloroacetyl)amino)methyl)-2,4,6-trimethylphenyl)amino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate

Registry Numbers

CAS Registry Number

  • 80010-51-1

System Generated Number

  • 0080010511

Molecular Formulas

Molecular Formula

  • C29-H28-Cl2-N4-O7-S.Na

Molecular Formula Fragments

  • C29-H28-Cl2-N4-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H28Cl2N4O7S.Na/c1-13-18(11-33-22(36)9-30)14(2)27(15(3)19(13)12-34-23(37)10-31)35-20-8-21(43(40,41)42)26(32)25-24(20)28(38)16-6-4-5-7-17(16)29(25)39;/h4-8,35H,9-12,32H2,1-3H3,(H,33,36)(H,34,37)(H,40,41,42);/q;+1/p-1

InChIKey

HVDUMYBPGXAPLG-UHFFFAOYSA-M

Smiles

[Na+].c1(c(cc(c2C(c3ccccc3C(c12)=O)=O)Nc1c(c(c(c(c1C)CNC(=O)CCl)C)CNC(=O)CCl)C)S(=O)(=O)[O-])N