Chem
J-GLOBAL ID:200907000371138420   Nikkaji number:J967.083A

3-[2-(1-Hydroperoxy-2-phenylethyl)-4,5-bis(methoxycarbonyl)-4-isoxazoline-3-yl]acrylic acid methyl ester

3-[2-(1-ヒドロペルオキシ-2-フェニルエチル)-4,5-ビス(メトキシカルボニル)-4-イソオキサゾリン-3-イル]アクリル酸メチル
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: C19H21NO9
Molecular formula furigana: C19-H21-N-O9
Molecular weight: 407.375
InChI: InChI=1S/C19H21NO9/c1-25-15(21)10-9-13-16(18(22)26-2)17(19(23)27-3)28-20(13)14(29-24)11-12-7-5-4-6-8-12/h4-10,13-14,24H,11H2,1-3H3
InChI key: ILDTWBNBRGTULQ-UHFFFAOYSA-N
SMILES: COC(=O)C=CC1N(OC(=C1C(=O)OC)C(=O)OC)C(Cc1ccccc1)OO
Systematic name  (3):
  • 3-[2-(1-ヒドロペルオキシ-2-フェニルエチル)-4,5-ビス(メトキシカルボニル)-4-イソオキサゾリン-3-イル]アクリル酸メチル
  • 4,5-ジメチル 2-(1-ヒドロペルオキシ-2-フェニルエチル)-3-(3-メトキシ-3-オキソプロパ-1-エン-1-イル)-2,3-ジヒドロ-1,2-オキサゾール-4,5-ジカルボキシラート
  • 4,5-dimethyl 2-(1-hydroperoxy-2-phenylethyl)-3-(3-methoxy-3-oxoprop-1-en-1-yl)-2,3-dihydro-1,2-oxazole-4,5-dicarboxylate
Other name (1):
  • 3-[2-(1-Hydroperoxy-2-phenylethyl)-4,5-bis(methoxycarbonyl)-4-isoxazoline-3-yl]acrylic acid methyl ester
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