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Substance Name: Benzenesulfonic acid, 4-(1-(((4-chloro-3-((4,4-dimethyl-1,3-dioxopentyl)amino)phenyl)amino)carbonyl)propoxy)-2-pentadecyl-, sodium salt (1:1)
RN: 63149-23-5
InChIKey: PGBXVYDSICJIMW-UHFFFAOYSA-M

Molecular Formula

  • C38-H57-Cl-N2-O7-S.Na

Molecular Weight

  • 743.376
 
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Names and Synonyms

  • Benzenesulfonic acid, 4-(1-(((4-chloro-3-((4,4-dimethyl-1,3-dioxopentyl)amino)phenyl)amino)carbonyl)propoxy)-2-pentadecyl-, sodium salt (1:1)
  • Benzenesulfonic acid, 4-(2-((4-chloro-3-((4,4-dimethyl-1,3-dioxopentyl)amino)phenyl)amino)-1-ethyl-2-oxoethoxy)-2-pentadecyl-, monosodium salt

Registry Numbers

CAS Registry Number

  • 63149-23-5

System Generated Number

  • 0063149235

Molecular Formulas

Molecular Formula

  • C38-H57-Cl-N2-O7-S.Na

Molecular Formula Fragments

  • C38-H57-Cl-N2-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H57ClN2O7S.Na/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-28-25-30(22-24-34(28)49(45,46)47)48-37(44)32(7-2)41-33-26-29(21-23-31(33)39)40-36(43)27-35(42)38(3,4)5;/h21-26,32,41H,6-20,27H2,1-5H3,(H,40,43)(H,45,46,47);/q;+1/p-1

InChIKey

PGBXVYDSICJIMW-UHFFFAOYSA-M

Smiles

C([C@@H](C(Oc1cc(c(S(=O)(=O)[O-])cc1)CCCCCCCCCCCCCCC)=O)Nc1c(Cl)ccc(NC(=O)CC(=O)C(C)(C)C)c1)C.[Na+]