Chem
J-GLOBAL ID：200907040981309768   Nikkaji number：J1.150.856A

2-[(E)-(3-Nitroanilino)methylene]-4,6-di-tert-butyl-3,5-cyclohexadiene-1-one

2-[(E)-(3-ニトロアニリノ)メチレン]-4,6-ジ-tert-ブチル-3,5-シクロヘキサジエン-1-オン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H26N[N+]O2[O-]
Molecular formula furigana： C21-H26-N2-O3
Molecular weight： 354.450
InChI： InChI=1S/C21H26N2O3/c1-20(2,3)15-10-14(19(24)18(11-15)21(4,5)6)13-22-16-8-7-9-17(12-16)23(25)26/h7-13,22H,1-6H3/b14-13+
InChI key： ZKARECWRBVKAJM-BUHFOSPRSA-N
SMILES： CC(C)(C)C1=C/C(=C\Nc2cccc(c2)[N+](=O)[O-])/C(=O)C(=C1)C(C)(C)C
Systematic name  (6)：
  • 2,4-ジ-tert-ブチル-6-[(E)-3-ニトロフェニルアミノメチレン]-2,4-シクロヘキサジエン-1-オン
  • 2,4-ジ-tert-ブチル-6-[(E)-[(3-ニトロフェニル)アミノ]メチレン]-2,4-シクロヘキサジエン-1-オン
  • 2-[(E)-(3-ニトロアニリノ)メチレン]-4,6-ジ-tert-ブチル-3,5-シクロヘキサジエン-1-オン
  • 2,4-ジ-tert-ブチル-6-[(E)-(3-ニトロフェニルアミノ)メチレン]-2,4-シクロヘキサジエン-1-オン
  • (6E)-2,4-ジ-tert-ブチル-6-{[(3-ニトロフェニル)アミノ]メチリデン}シクロヘキサ-2,4-ジエン-1-オン
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Other name (4)：
  • 2,4-Di-tert-butyl-6-[(E)-3-nitrophenylaminomethylene]-2,4-cyclohexadiene-1-one
  • 2,4-Di-tert-butyl-6-[(E)-[(3-nitrophenyl)amino]methylene]-2,4-cyclohexadiene-1-one
  • 2-[(E)-(3-Nitroanilino)methylene]-4,6-di-tert-butyl-3,5-cyclohexadiene-1-one
  • 2,4-Di-tert-butyl-6-[(E)-(3-nitrophenylamino)methylene]-2,4-cyclohexadiene-1-one
Thsaurus map：
Thesaurus Map

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