HCID12391117

2-Amino-4-(3-nitrophenyl)-1,4,5,6,7,8-hexahydro-5-oxoquinoline-3-carboxylic acid ethyl ester

ethyl 2-amino-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

C18H19N3O5357.4 g/mol

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)C1=C(N)NC2=C(C(=O)CCC2)C1c1cccc([N+](=O)[O-])c1
InChIKey: LXAIKYRVRSBQOX-UHFFFAOYSA-N
分子式: C18H19N3O5
平均分子量: 357.4 g/mol
单同位素质量: 357.13247072

COMPUTED

结构计算性质

已同步

XLogP: 2.3
极性表面积: 127 Å²
氢键供体: 2
氢键受体: 7
可旋转键: 4
重原子: 26
形式电荷: 0
复杂度: 691

ALIASES

名称与别名

共 4 条

SCHEMBL11688607LXAIKYRVRSBQOX-UHFFFAOYSA-N2-amino-4-(3-nitrophenyl)-1,4,5,6, 7,8-hexahydro-5-oxoquinoline-3-carboxylic acid ethyl ester2-amino-4-(3-nitrophenyl)-1,4,5,6,7,8-hexahydro-5-oxoquinoline-3-carboxylic acid ethyl ester

REACTIONS

参与反应

8 条

uspto-grants-1976_03 · 10.6084/m9.figshare.5104873.v1 · US03946026

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uspto-grants-1976_07 · 10.6084/m9.figshare.5104873.v1 · US03971791

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uspto-grants-1976_07 · 10.6084/m9.figshare.5104873.v1 · US03971790

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uspto-grants-1977_01 · 10.6084/m9.figshare.5104873.v1 · US04001235

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uspto-grants-1977_01 · 10.6084/m9.figshare.5104873.v1 · US04001258

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uspto-grants-1976_02 · 10.6084/m9.figshare.5104873.v1 · US03939171

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uspto-grants-1976_01 · 10.6084/m9.figshare.5104873.v1 · US03935223

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uspto-grants-1977_05 · 10.6084/m9.figshare.5104873.v1 · US04022898

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