4-(2-(1,3-BENZODIOXOL-5-YLCARBONYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE

CAS号
CCD编号
CCD00339461
分子式
C22 H15 Cl N2 O5
分子量
422.823

基本信息

产品名称: 4-(2-(1,3-BENZODIOXOL-5-YLCARBONYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
英文同义词: 4-(2-(1,3-BENZODIOXOL-5-YLCARBONYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
MDL号: MFCD02840521
氢键受体数量: 7
氢键供体数量: 1
Smile: c1ccc(c(c1)C(=O)Oc2ccc(cc2)/C=N/NC(=O)c3ccc4c(c3)OCO4)Cl
InChi: InChI=1S/C22H15ClN2O5/c23-18-4-2-1-3-17(18)22(27)30-16-8-5-14(6-9-16)12-24-25-21(26)15-7-10-19-20(11-15)29-13-28-19/h1-12H,13H2,(H,25,26)/b24-12+
InChiKey: InChIKey=NIZSMCDKFXXMJJ-WYMPLXKRSA-N

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