Olaparib Impurity 58结构式

Olaparib Impurity 58
中文名称:Olaparib Impurity 58
英文名称:Olaparib Impurity 58
CAS No.:2630919-53-6
分子式:C16H10FNO3 分子量:283.25
Olaparib Impurity 58 数据
Mol:
0  0  0  0  0  0  0  0  0  0  0  0
    6.9616   -0.3272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0621   -2.2301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8243   -1.7553    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.0735   -3.2563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1887   -3.7632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9163   -3.2567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0392   -3.7772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  2 21  2  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  7  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  9  2  0  0  0  0
  8 20  1  0  0  0  0
  9 10  1  0  0  0  0
 10 19  1  0  0  0  0
 11 10  2  0  0  0  0
 11 13  1  0  0  0  0
 12 13  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  2  0  0  0  0
 14 12  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 19 18  2  0  0  0  0
 20  7  2  0  0  0  0
 21 20  1  0  0  0  0
M  END
                                
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Olaparib Impurity 58 Smile 编码:
C1=CC2=C(C=C1)/C(=C/C1=CC(=C(C=C1)F)C(N)=O)/OC2=O
Olaparib Impurity 58 InChi 编码:
1S/C16H10FNO3/c17-13-6-5-9(7-12(13)15(18)19)8-14-10-3-1-2-4-11(10)16(20)21-14/h1-8H,(H2,18,19)/b14-8-
Olaparib Impurity 58 InChiKey 编码:
DBEGFJBBWWADOB-ZSOIEALJSA-N