氟斯必灵结构式

氟斯必灵
中文名称:氟斯必灵
英文名称:fluspirilene
CAS No.:1841-19-6
分子式:C29H31N3OF2 分子量:475.57274
氟斯必灵 数据
Mol:
 0
    9.9916    3.6860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6607    4.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5000   -1.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5000   -1.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5000   -0.0990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0000   -2.6971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -1.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0000   -2.6971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -0.0990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5000   -3.5631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -0.9651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5000   -3.5631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 34  1  0  0  0  0
  2 35  1  0  0  0  0
  3 12  2  0  0  0  0
  4  7  1  0  0  0  0
  4 13  1  0  0  0  0
  4 15  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 14  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 14 16  1  0  0  0  0
 15 19  2  0  0  0  0
 15 20  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 20 24  2  0  0  0  0
 21 26  2  0  0  0  0
 21 28  1  0  0  0  0
 22 27  2  0  0  0  0
 22 29  1  0  0  0  0
 23 25  2  0  0  0  0
 24 25  1  0  0  0  0
 26 30  1  0  0  0  0
 27 31  1  0  0  0  0
 28 32  2  0  0  0  0
 29 33  2  0  0  0  0
 30 34  2  0  0  0  0
 31 35  2  0  0  0  0
 32 34  1  0  0  0  0
 33 35  1  0  0  0  0
M  END                                
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氟斯必灵 Smile 编码:
FC1C=CC(=CC=1)C(C1C=CC(=CC=1)F)CCCN1CCC2(C(NCN2C2C=CC=CC=2)=O)CC1
氟斯必灵 InChi 编码:
InChI=1S/C29H31F2N3O/c30-24-12-8-22(9-13-24)27(23-10-14-25(31)15-11-23)7-4-18-33-19-16-29(17-20-33)28(35)32-21-34(29)26-5-2-1-3-6-26/h1-3,5-6,8-15,27H,4,7,16-21H2,(H,32,35)
氟斯必灵 InChiKey 编码:
QOYHHIBFXOOADH-UHFFFAOYSA-N