2-Butanone, 4-(4-methoxyphenyl)-3-[(4-nitrobenzoyl)oxy]-结构式

2-Butanone, 4-(4-methoxyphenyl)-3-[(4-nitrobenzoyl)oxy]-
英文名称:2-Butanone, 4-(4-methoxyphenyl)-3-[(4-nitrobenzoyl)oxy]-
CAS No.:761451-17-6
分子式:C18H17NO6 分子量:343.331
2-Butanone, 4-(4-methoxyphenyl)-3-[(4-nitrobenzoyl)oxy]- 数据
Mol:
  0  0  0  0  0  0  0  0  0  0
    2.7193    3.1400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    2.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.1400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    0.7850    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7193    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000    7.8500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  3  2  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 10 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 16  2  0  0  0  0
 19 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 15 25  2  0  0  0  0
M  CHG  1  22   1
M  CHG  1  24  -1
M  END                                
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2-Butanone, 4-(4-methoxyphenyl)-3-[(4-nitrobenzoyl)oxy]- Smile 编码:
COC1=CC=C(CC(OC(=O)C2=CC=C([N+]([O-])=O)C=C2)C(=O)C)C=C1