
C21H22ClFN4O2
3110272-60-8 Copyright (C) 2026 ACS
 29 32  0  0  0  0  0  0  0  0999 V2000
    7.7001    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    5.3348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    6.6684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.3348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100   12.0032    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.3901    6.6684    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9301    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    5.3348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7001    5.3348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3901    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9301    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    2.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7001    2.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3901    1.3337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9301    1.3337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3901    9.3359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    9.3359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201   10.6695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800   10.6695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2401    8.0021    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0101    9.3359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0101    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5501    9.3359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5501    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3201    8.0021    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 24  1  0  0  0  0
  2 10  2  0  0  0  0
  3  4  1  0  0  0  0
  3 19  1  0  0  0  0
  4  5  1  0  0  0  0
  6 23  1  0  0  0  0
  7 16  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 18  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 17  2  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 23  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
> <cas.rn>
3110272-60-8

> <ca.index.name>
Not Yet Assigned

> <molecular.formula>
C21H22ClFN4O2

> <smiles.canonical>
O=C1C=2C=C(F)C=CC2N=C(N1C3=CC=C(Cl)C=C3OCC)CN4CCNCC4

> <molecular.weight>
416.88

$$$$
