Chem
J-GLOBAL ID:201807010089816055   Nikkaji number:J3.727.872F

2,2,2-Trichloroacetimidic acid (S,E)-1-methyl-2-(2-oxotetrahydro-2H-pyran-3-ylidene)ethyl ester

(2S)-1-[(3E)-2-オキソオキサン-3-イリデン]プロパン-2-イル 2,2,2-トリクロロエタンイミダート
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: C10H12Cl3NO3
Molecular formula furigana: C10-H12-CL3-N-O3
Molecular weight: 300.560
InChI: InChI=1S/C10H12Cl3NO3/c1-6(17-9(14)10(11,12)13)5-7-3-2-4-16-8(7)15/h5-6,14H,2-4H2,1H3/b7-5+,14-9?/t6-/m0/s1
InChI key: AAARMHSBRRXIPZ-WCGPTGQOSA-N
SMILES: C[C@H](OC(=N)C(Cl)(Cl)Cl)/C=C/1\CCCOC1=O
Systematic name  (3):
  • 2,2,2-トリクロロアセトイミド酸(S,E)-1-メチル-2-(2-オキソテトラヒドロ-2H-ピラン-3-イリデン)エチル
  • (2S)-1-[(3E)-2-オキソオキサン-3-イリデン]プロパン-2-イル 2,2,2-トリクロロエタンイミダート
  • (2S)-1-[(3E)-2-oxooxan-3-ylidene]propan-2-yl 2,2,2-trichloroethanimidate
Other name (1):
  • 2,2,2-Trichloroacetimidic acid (S,E)-1-methyl-2-(2-oxotetrahydro-2H-pyran-3-ylidene)ethyl ester
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