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Substance Name: Acetic acid, 2-(2,3-bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)-2-cyano-, ethyl ester
RN: 63165-90-2
InChIKey: IWYGJMCZNICZCX-UHFFFAOYSA-N

Molecular Formula

  • C36-H45-N-O4

Molecular Weight

  • 555.755
 
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Names and Synonyms

Synonym

  • Ethyl (bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadiene-1-ylidene)cyclopropylidene)cyanoacetate

Systematic Names

  • Acetic acid, (bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)cyano-, ethyl ester
  • Acetic acid, 2-(2,3-bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)-2-cyano-, ethyl ester

Registry Numbers

CAS Registry Number

  • 63165-90-2

System Generated Number

  • 0063165902

Structure Descriptors

InChI

1S/C36H45NO4/c1-14-41-32(40)22(19-37)29-27(20-15-23(33(2,3)4)30(38)24(16-20)34(5,6)7)28(29)21-17-25(35(8,9)10)31(39)26(18-21)36(11,12)13/h15-18H,14H2,1-13H3

InChIKey

IWYGJMCZNICZCX-UHFFFAOYSA-N

Smiles

O=C(OCC)\C(C#N)=C1\C(=C2/C=C(C(=O)C(C(C)(C)C)=C2)C(C)(C)C)\C1=C1/C=C(C(=O)C(C(C)(C)C)=C1)C(C)(C)C