Molecule FYI-1001376

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A

Molecule Summary:

ID: FYI-1001376
SMILES: CN(C)CCCC3(c1ccc(C(F)(F)F)cc1)OCc2c[c+2](N)ccc23

Received at FYIcenter.com on: 2022-06-16

Molecule ID: FYI-1001376 Edit

Molecule Structure SMILES String: CN(C)CCCC3(c1ccc(C(F)(F)F)cc1)OCc2c[c+2](N)ccc23

Download SDF Download SVG Structure in 2D SDF:

FYI-1001376
FYIcenter.com

 54 56  0  0  0  0  0  0  0  0999 V2000
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   -0.1545    6.0463   -0.5088 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7308    3.6948   -0.4748 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4563    2.3768    0.2520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4486    1.3147   -0.2257 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1741   -0.0034    0.5012 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2692   -0.4003    0.3266 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2202    0.0361    1.2299 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5440   -0.3280    1.0697 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9168   -1.1289    0.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6010   -2.7225    0.5145 F   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6411   -1.2055   -0.7337 C   0  0  0  0  0  0  0  0  0  0  0  0
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 24 52  1  0  0  0  0
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 26 54  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001376-3D
FYIcenter.com

 49 51  0  0  1  0  0  0  0  0999 V2000
    2.5283    2.2333    0.0299 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2173    1.5655    1.2951 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7705    1.3609    1.3999 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9267    0.2806    1.4372 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4580    0.4106    1.4800 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9376    1.3190    2.6259 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4669    1.5702    2.6319 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.9312    2.2327    1.3245 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4263    3.4886    0.9550 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8395    4.1422   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7388    3.5278   -1.0756 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1715    4.2309   -2.3371 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6322    5.4769   -2.4738 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.5197    4.4035   -2.4076 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.8180    3.5518   -3.4630 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.2133    2.2457   -0.7558 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.4629    1.4829    4.7844 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8516    1.9172    6.0488 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6971    3.2677    6.3837 C   0  2  0  0  0  0  0  0  0  0  0  0
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 25 49  1  0  0  0  0
M  END
$$$$

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2022-07-26, 2229👍, 0💬