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Substance Name: Sodium 3-((3-(4-(hexadecyloxy)phenyl)-1,3-dioxopropyl)amino)benzenesulphonate
RN: 14542-05-3
InChIKey: VASNKHYSFYDYEM-UHFFFAOYSA-M

Molecular Formula

  • C31-H45-N-O6-S.Na

Molecular Weight

  • 581.7456
 
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Names and Synonyms

Synonym

  • EINECS 238-574-1

Systematic Name

  • Sodium 3-((3-(4-(hexadecyloxy)phenyl)-1,3-dioxopropyl)amino)benzenesulphonate

Registry Numbers

CAS Registry Number

  • 14542-05-3

System Generated Number

  • 0014542053

Molecular Formulas

Molecular Formula

  • C31-H45-N-O6-S.Na

Molecular Formula Fragments

  • C31-H45-N-O6-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C31H45NO6S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-38-28-21-19-26(20-22-28)30(33)25-31(34)32-27-17-16-18-29(24-27)39(35,36)37;/h16-22,24H,2-15,23,25H2,1H3,(H,32,34)(H,35,36,37);/q;+1/p-1

InChIKey

VASNKHYSFYDYEM-UHFFFAOYSA-M

Smiles

CCCCCCCCCCCCCCCCOc1ccc(cc1)C(=O)CC(=O)Nc2cccc(c2)S(=O)(=O)[O-].[Na+]