Chem
J-GLOBAL ID：201307053426322152   Nikkaji number：J3.126.475H

2-[Methyl[4-oxo-4-(4-methoxyphenyl)-2-butynyl]amino]-2-(trifluoromethyl)-3,4-pentadienoic acid methyl ester

2-[メチル[4-オキソ-4-(4-メトキシフェニル)-2-ブチニル]アミノ]-2-(トリフルオロメチル)-3,4-ペンタジエン酸メチル
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： C19H18F3NO4
Molecular formula furigana： C19-H18-F3-N-O4
Molecular weight： 381.351
InChI： InChI=1S/C19H18F3NO4/c1-5-12-18(17(25)27-4,19(20,21)22)23(2)13-6-7-16(24)14-8-10-15(26-3)11-9-14/h8-12H,1,13H2,2-4H3
InChI key： LKHDRNMYPHWDNP-UHFFFAOYSA-N
SMILES： COC(=O)C(C=C=C)(N(C)CC#CC(=O)c1ccc(OC)cc1)C(F)(F)F
Systematic name  (3)：
  • 2-[メチル[4-オキソ-4-(4-メトキシフェニル)-2-ブチニル]アミノ]-2-(トリフルオロメチル)-3,4-ペンタジエン酸メチル
  • メチル 2-{[4-(4-メトキシフェニル)-4-オキソブタ-2-イン-1-イル](メチル)アミノ}-2-(トリフルオロメチル)ペンタ-3,4-ジエノアート
  • methyl 2-{[4-(4-methoxyphenyl)-4-oxobut-2-yn-1-yl](methyl)amino}-2-(trifluoromethyl)penta-3,4-dienoate
Other name (1)：
  • 2-[Methyl[4-oxo-4-(4-methoxyphenyl)-2-butynyl]amino]-2-(trifluoromethyl)-3,4-pentadienoic acid methyl ester
Thsaurus map：
Thesaurus Map

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