
 CHEMBL2205078

 61 65  0  0  0  0  0  0  0  0999 V2000
    2.4354    1.7441    0.9426 C   0  0  0  0  0
    0.9401    1.7184    0.6002 C   0  0  0  0  0
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    1.9032    1.8441   -3.1172 C   0  0  0  0  0
    0.9898    1.8798   -4.3611 N   0  0  0  0  0
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    0.0733    4.0143   -9.7082 N   0  0  0  0  0
    1.4207    4.0665  -10.2368 C   0  0  0  0  0
    0.2774    0.6685    1.5154 C   0  0  0  0  0
    3.0174    2.4411    0.3367 H   0  0  0  0  0
    2.8798    0.7528    0.8022 H   0  0  0  0  0
    2.5818    2.0333    1.9893 H   0  0  0  0  0
   -0.2858    3.4470    1.4544 H   0  0  0  0  0
    0.3259    5.0984   -0.3696 H   0  0  0  0  0
    1.7888    4.5994    0.4957 H   0  0  0  0  0
    2.1875    4.4222   -2.0303 H   0  0  0  0  0
    0.3206    0.6115   -1.2990 H   0  0  0  0  0
   -1.5843    1.8402   -0.0776 H   0  0  0  0  0
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    2.6285    1.8026   -5.7386 H   0  0  0  0  0
    1.0884    1.1144   -6.3700 H   0  0  0  0  0
    2.0436    0.2024   -5.1714 H   0  0  0  0  0
   -0.9117    1.6442   -3.4008 H   0  0  0  0  0
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    1.6323    3.8748   -4.7965 H   0  0  0  0  0
    0.1293    3.7834   -3.8716 H   0  0  0  0  0
    1.5933    3.7280   -7.2841 H   0  0  0  0  0
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   -4.3315    4.0560   -9.5867 H   0  0  0  0  0
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   -0.3244    4.2712  -12.5536 H   0  0  0  0  0
    2.1524    3.9904   -9.4319 H   0  0  0  0  0
    1.5501    5.0198  -10.7564 H   0  0  0  0  0
    1.5515    3.2288  -10.9273 H   0  0  0  0  0
   -0.7965    0.5562    1.3490 H   0  0  0  0  0
    0.4141    0.9376    2.5686 H   0  0  0  0  0
    0.7297   -0.3167    1.3560 H   0  0  0  0  0
  1  2  1  0  0  0
  1 29  1  0  0  0
  1 30  1  0  0  0
  1 31  1  0  0  0
  2  7  1  0  0  0
  2  3  1  0  0  0
  2 28  1  0  0  0
  3  4  1  0  0  0
  3  8  1  0  0  0
  3 32  1  0  0  0
  4  5  1  0  0  0
  4 33  1  0  0  0
  4 34  1  0  0  0
  5  6  2  0  0  0
  5 35  1  0  0  0
  6  7  1  0  0  0
  6  9  1  0  0  0
  7  8  1  0  0  0
  7 36  1  0  0  0
  8 37  1  0  0  0
  8 38  1  0  0  0
  9 10  1  0  0  0
  9 39  1  0  0  0
  9 40  1  0  0  0
 10 13  1  0  0  0
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 10 11  1  0  0  0
 11 41  1  0  0  0
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 27 58  1  0  0  0
 28 59  1  0  0  0
 28 60  1  0  0  0
 28 61  1  0  0  0
M  CHG  1  10   1
M  END

>  <Chemical Name>
CHEMBL2205078

>  <PubChem CID>
71452316

>  <Formula>
C26H33N2+

>  <Molecular Weight>
373.564000

>  <IUPAC Name>
[(1S,5R)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methyl-dimethyl-[(9-methylcarbazol-2-yl)methyl]azanium

>  <XlogP>
5.2

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
0

>  <Canonical SMILES>
CC1(C2CC=C(C1C2)C[N+](C)(C)CC3=CC4=C(C=C3)C5=CC=CC=C5N4C)C

>  <Isomeric SMILES>
CC1([C@H]2CC=C([C@@H]1C2)C[N+](C)(C)CC3=CC4=C(C=C3)C5=CC=CC=C5N4C)C

>  <InChI Std. ID>
InChI=1S/C26H33N2/c1-26(2)20-12-11-19(23(26)15-20)17-28(4,5)16-18-10-13-22-21-8-6-7-9-24(21)27(3)25(22)14-18/h6-11,13-14,20,23H,12,15-17H2,1-5H3/q+1/t20-,23-/m0/s1

>  <InChI Key>
ADJZEARNEOEAPU-REWPJTCUSA-N

