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Substance Name: 2-(4-((1,3-Dioxo-3-phenylpropyl)amino)phenyl)-1-octadecyl-1H-benzimidazole-5-sulphonic acid
RN: 5149-72-4
InChIKey: ZCDJHOQJPIXSCQ-UHFFFAOYSA-N

Molecular Formula

  • C40-H53-N3-O5-S

Molecular Weight

  • 687.9407
 
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Names and Synonyms

Synonym

  • EINECS 225-920-1

Systematic Name

  • 2-(4-((1,3-Dioxo-3-phenylpropyl)amino)phenyl)-1-octadecyl-1H-benzimidazole-5-sulphonic acid

Registry Numbers

CAS Registry Number

  • 5149-72-4

System Generated Number

  • 0005149724

Structure Descriptors

InChI

1S/C40H53N3O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-29-43-37-28-27-35(49(46,47)48)30-36(37)42-40(43)33-23-25-34(26-24-33)41-39(45)31-38(44)32-21-18-17-19-22-32/h17-19,21-28,30H,2-16,20,29,31H2,1H3,(H,41,45)(H,46,47,48)

InChIKey

ZCDJHOQJPIXSCQ-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCCCn1c2ccc(cc2nc1c3ccc(cc3)NC(=O)CC(=O)c4ccccc4)S(=O)(=O)O