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Substance Name: 1-(2-((4-((Dimethylamino)methyl)phenyl)ethynyl)phenoxy)-3-((1,1-dimethylethyl)amino)-2-propanol fumarate
RN: 126661-33-4
InChIKey: ITLSDGRKEONSSH-WLHGVMLRSA-N

Molecular Formula

  • C28-H36-N2-O6

Molecular Weight

  • 496.6
 
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Names and Synonyms

  • 1-(2-((4-((Dimethylamino)methyl)phenyl)ethynyl)phenoxy)-3-((1,1-dimethylethyl)amino)-2-propanol fumarate

Registry Numbers

CAS Registry Number

  • 126661-33-4

System Generated Number

  • 0126661334

Structure Descriptors

InChI

1S/C24H32N2O2.C4H4O4/c1-24(2,3)25-16-22(27)18-28-23-9-7-6-8-21(23)15-14-19-10-12-20(13-11-19)17-26(4)5;5-3(6)1-2-4(7)8/h6-13,22,25,27H,16-18H2,1-5H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

ITLSDGRKEONSSH-WLHGVMLRSA-N

Smiles

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