
 OPC-28326

 66 68  0  0  0  0  0  0  0  0999 V2000
    0.2858    1.6853   -4.3039 C   0  0  0  0  0
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    8.1685    8.6191   -0.2144 C   0  0  0  0  0
   11.1284    7.5823    0.0069 N   0  0  0  0  0
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   13.2286   11.6805    3.8613 C   0  0  0  0  0
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   15.2048   11.1649    2.5756 C   0  0  0  0  0
   14.5755   10.0293    2.0643 C   0  0  0  0  0
    5.2417    3.8609   -4.0149 C   0  0  0  0  0
   -0.2336    0.7370   -4.4719 H   0  0  0  0  0
    0.4433    2.1644   -5.2756 H   0  0  0  0  0
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    1.3992    0.9608   -2.6195 H   0  0  0  0  0
    2.7863    2.1286   -1.4838 H   0  0  0  0  0
    6.3050    6.0340   -2.8823 H   0  0  0  0  0
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    3.1633    2.9040    1.0112 H   0  0  0  0  0
    8.0016    5.4368   -1.4314 H   0  0  0  0  0
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   10.2885    5.9278   -2.1351 H   0  0  0  0  0
    9.2107    7.0936   -2.8460 H   0  0  0  0  0
   11.1422    8.2973   -1.9854 H   0  0  0  0  0
    9.7839    9.9870   -0.6635 H   0  0  0  0  0
    8.9730    9.3483   -2.0634 H   0  0  0  0  0
    8.4790    8.4265    0.8202 H   0  0  0  0  0
    7.4263    9.4265   -0.1847 H   0  0  0  0  0
   11.5097    5.5523   -0.5325 H   0  0  0  0  0
   12.5381    6.1421    0.7080 H   0  0  0  0  0
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   12.7040   12.3236    4.5631 H   0  0  0  0  0
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   16.2213   11.4046    2.2747 H   0  0  0  0  0
   15.1150    9.3934    1.3661 H   0  0  0  0  0
    5.1973    2.7669   -4.0233 H   0  0  0  0  0
    6.2699    4.1241   -4.2896 H   0  0  0  0  0
    4.5792    4.2688   -4.7810 H   0  0  0  0  0
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  1 32  1  0  0  0
  1 33  1  0  0  0
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  2  3  1  0  0  0
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  3  5  1  0  0  0
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 31 66  1  0  0  0
M  END

>  <Chemical Name>
OPC-28326

>  <PubChem CID>
219020

>  <Formula>
C26H35N3O2

>  <Molecular Weight>
421.585000

>  <IUPAC Name>
N-[2,6-dimethyl-4-[4-[methyl(2-phenylethyl)amino]piperidine-1-carbonyl]phenyl]propanamide

>  <XlogP>
4.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CCC(=O)NC1=C(C=C(C=C1C)C(=O)N2CCC(CC2)N(C)CCC3=CC=CC=C3)C

>  <Isomeric SMILES>
CCC(=O)NC1=C(C=C(C=C1C)C(=O)N2CCC(CC2)N(C)CCC3=CC=CC=C3)C

>  <InChI Std. ID>
InChI=1S/C26H35N3O2/c1-5-24(30)27-25-19(2)17-22(18-20(25)3)26(31)29-15-12-23(13-16-29)28(4)14-11-21-9-7-6-8-10-21/h6-10,17-18,23H,5,11-16H2,1-4H3,(H,27,30)

>  <InChI Key>
BESKMDLUOAVUJF-UHFFFAOYSA-N

