Chem
J-GLOBAL ID：200907002418393923   Nikkaji number：J334.085F

2-[[4-(6,6-Dimethyl-2-cyclohexen-1-yl)-2-methyl-3-butenylidene]amino]benzoic acid methyl ester

2-[[4-(6,6-ジメチル-2-シクロヘキセン-1-イル)-2-メチル-3-ブテニリデン]アミノ]安息香酸メチル
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： C21H27NO2
Molecular formula furigana： C21-H27-N-O2
Molecular weight： 325.452
InChI： InChI=1S/C21H27NO2/c1-16(12-13-17-9-7-8-14-21(17,2)3)15-22-19-11-6-5-10-18(19)20(23)24-4/h5-7,9-13,15-17H,8,14H2,1-4H3
InChI key： UJEHPJROBVIUFU-UHFFFAOYSA-N
SMILES： COC(=O)c1ccccc1N=CC(C)C=CC1C=CCCC1(C)C
Systematic name  (3)：
  • 2-[[4-(6,6-ジメチル-2-シクロヘキセン-1-イル)-2-メチル-3-ブテニリデン]アミノ]安息香酸メチル
  • メチル 2-{[4-(6,6-ジメチルシクロヘキサ-2-エン-1-イル)-2-メチルブタ-3-エン-1-イリデン]アミノ}ベンゾアート
  • methyl 2-{[4-(6,6-dimethylcyclohex-2-en-1-yl)-2-methylbut-3-en-1-ylidene]amino}benzoate
Other name (1)：
  • 2-[[4-(6,6-Dimethyl-2-cyclohexen-1-yl)-2-methyl-3-butenylidene]amino]benzoic acid methyl ester
CAS registry number： 68140-57-8
Regulation number (2)：
  • EINECS2688088
  • TSCA(68140-57-8)
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