Chem
J-GLOBAL ID：201807007068217657   Nikkaji number：J3.727.871H

(E,S)-2-[3-[(p-Methoxybenzyl)oxy]propyl]-4-[(2,2,2-trichloroacetimidoyl)oxy]-2-pentenoic acid methyl ester

(E,S)-2-[3-[(p-メトキシベンジル)オキシ]プロピル]-4-[(2,2,2-トリクロロアセトイミドイル)オキシ]-2-ペンテン酸メチル
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： C19H24Cl3NO5
Molecular formula furigana： C19-H24-CL3-N-O5
Molecular weight： 452.750
InChI： InChI=1S/C19H24Cl3NO5/c1-13(28-18(23)19(20,21)22)11-15(17(24)26-3)5-4-10-27-12-14-6-8-16(25-2)9-7-14/h6-9,11,13,23H,4-5,10,12H2,1-3H3/b15-11+,23-18?/t13-/m0/s1
InChI key： WAPXAOFFFOBGKI-TTZRUXKJSA-N
SMILES： COC(=O)/C(=C/[C@H](C)OC(=N)C(Cl)(Cl)Cl)/CCCOCc1ccc(OC)cc1
Systematic name  (3)：
  • (E,S)-2-[3-[(p-メトキシベンジル)オキシ]プロピル]-4-[(2,2,2-トリクロロアセトイミドイル)オキシ]-2-ペンテン酸メチル
  • メチル (2E,4S)-2-{3-[(4-メトキシフェニル)メトキシ]プロピル}-4-[(2,2,2-トリクロロエタンイミドイル)オキシ]ペンタ-2-エノアート
  • methyl (2E,4S)-2-{3-[(4-methoxyphenyl)methoxy]propyl}-4-[(2,2,2-trichloroethanimidoyl)oxy]pent-2-enoate
Other name (1)：
  • (E,S)-2-[3-[(p-Methoxybenzyl)oxy]propyl]-4-[(2,2,2-trichloroacetimidoyl)oxy]-2-pentenoic acid methyl ester
Thsaurus map：
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