HCID70018101

Ethyl 3-(2,4-dichlorophenylacetylamino)-3-(3-nitrophenyl)-propionate

ethyl 3-[[2-chloro-2-(4-chlorophenyl)acetyl]amino]-3-(3-nitrophenyl)propanoate

C19H18Cl2N2O5425.3 g/mol

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)CC(NC(=O)C(Cl)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1
InChIKey: VVKVCMGHJSKQSG-UHFFFAOYSA-N
分子式: C19H18Cl2N2O5
平均分子量: 425.3 g/mol
单同位素质量: 424.0592771

COMPUTED

结构计算性质

已同步

XLogP: 4
极性表面积: 101 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 8
重原子: 28
形式电荷: 0
复杂度: 549

ALIASES

名称与别名

共 4 条

SCHEMBL7194108VVKVCMGHJSKQSG-UHFFFAOYSA-NEthyl 3-(2,4-dichlorophenylacetylamino) -3-(3-nitrophenyl)-propionateEthyl 3-(2,4-dichlorophenylacetylamino)-3-(3-nitrophenyl)-propionate

REACTIONS

参与反应

5 条

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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uspto-grants-2003_07 · 10.6084/m9.figshare.5104873.v1 · US06589972B2

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uspto-grants-2003_07 · 10.6084/m9.figshare.5104873.v1 · US06589972B2

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uspto-grants-2001_09 · 10.6084/m9.figshare.5104873.v1 · US06291503B1

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uspto-grants-2001_09 · 10.6084/m9.figshare.5104873.v1 · US06291503B1

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