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Substance Name: Formamide, N-(4-((2-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)ethynyl)phenyl)-, (E)-2-butenedioate (1:1)(salt)
RN: 126661-34-5
InChIKey: SEEFMMVHRDFGRV-WLHGVMLRSA-N

Molecular Weight

  • 482.53
 
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Names and Synonyms

  • Formamide, N-(4-((2-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)ethynyl)phenyl)-, (E)-2-butenedioate (1:1)(salt)

Registry Numbers

CAS Registry Number

  • 126661-34-5

System Generated Number

  • 0126661345

Structure Descriptors

InChI

1S/C22H26N2O3.C4H4O4/c1-22(2,3)24-14-20(26)15-27-21-7-5-4-6-18(21)11-8-17-9-12-19(13-10-17)23-16-25;5-3(6)1-2-4(7)8/h4-7,9-10,12-13,16,20,24,26H,14-15H2,1-3H3,(H,23,25);1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

SEEFMMVHRDFGRV-WLHGVMLRSA-N

Smiles

c1cc(OC[C@@H](O)CNC(C)(C)C)c(C#Cc2ccc(cc2)NC=O)cc1.OC(\C=C\C(=O)O)=O