Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- COC(=O)CC(c1ccc(OC)c(OC)c1)N1C(=O)c2ccccc2C1=O
- InChIKey
- GHTLZEXBRLQMFS-UHFFFAOYSA-N
- 分子式
- C20H19NO6
- 平均分子量
- 369.4 g/mol
- 单同位素质量
- 369.12123733
COMPUTED
结构计算性质
- XLogP
- 2.2
- 极性表面积
- 82.1 Ų
- 氢键供体
- 0
- 氢键受体
- 6
- 可旋转键
- 7
- 重原子
- 27
- 形式电荷
- 0
- 复杂度
- 555
ALIASES
名称与别名
CHEMBL88935SCHEMBL6691621SCHEMBL29441528GHTLZEXBRLQMFS-UHFFFAOYSA-NBDBM50052596CC-1104methyl 3-phthalimido-3-(3,4-dimethoxyphenyl)propionatemethyl 3-phthalimido-3-(3',4'-dimethoxyphenyl)propionateMethyl 3-(3,4-dimethoxyphenyl)-3-(1,3-dioxoisoindolin-2-yl)propanoate3-(3,4-Dimethoxy-phenyl)-3-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-propionic acid methyl ester
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D
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