Chem
J-GLOBAL ID:201807014043180330
Nikkaji number:J3.727.870J
(E,S)-2-Methyl-4-[(2,2,2-trichloroacetimidoyl)oxy]-2-pentenoic acid methyl ester
(E,S)-2-メチル-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
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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:
C9 H12 Cl3 NO3
Molecular formula furigana:
C9-H12-CL3-N-O3
Molecular weight:
288.550
InChI:
InChI=1S/C9H12Cl3NO3/c1-5(7(14)15-3)4-6(2)16-8(13)9(10,11)12/h4,6,13H,1-3H3/b5-4+,13-8?/t6-/m0/s1
InChI key:
UEBYBSBRDHYTOY-NAWMMQBISA-N
SMILES:
COC(=O)/C(=C/[C@H](C)OC(=N)C(Cl)(Cl)Cl)/C
Systematic name (3):
(E,S)-2-メチル-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-メチル-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-methyl-4-[(2,2,2-trichloroethanimidoyl)oxy]pent-2-enoate
Other name (1):
(E,S)-2-Methyl-4-[(2,2,2-trichloroacetimidoyl)oxy]-2-pentenoic acid methyl ester
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