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Substance Name: NSC 81687
RN: 4359-97-1
InChIKey: HRLDHROCDBYHAU-UHFFFAOYSA-N

Molecular Formula

  • C29-H42-O2

Molecular Weight

  • 422.649
 
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Names and Synonyms

Results Name

  • NSC 81687

Synonyms

  • 4-((3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-2,6-bis(1,1-dimethylethyl)-2,5-cyclohexadien-1-one
  • NSC 81687

Systematic Name

  • 2,5-Cyclohexadien-1-one, 4-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-2,6-bis(1,1-dimethylethyl)-

Registry Numbers

CAS Registry Number

  • 4359-97-1

System Generated Number

  • 0004359971

Structure Descriptors

InChI

1S/C29H42O2/c1-26(2,3)20-14-18(15-21(24(20)30)27(4,5)6)13-19-16-22(28(7,8)9)25(31)23(17-19)29(10,11)12/h13-17,30H,1-12H3

InChIKey

HRLDHROCDBYHAU-UHFFFAOYSA-N

Smiles

C=1(C(C(C(C)(C)C)=CC(\C1)=C\c1cc(C(C)(C)C)c(c(c1)C(C)(C)C)O)=O)C(C)(C)C