
 CHEMBL2441948

 57 57  0  0  0  0  0  0  0  0999 V2000
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   -0.5649    0.6400   -3.4320 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL2441948

>  <PubChem CID>
73355648

>  <Formula>
C20H30ClF3N2O

>  <Molecular Weight>
406.918000

>  <IUPAC Name>
4-piperidin-1-yl-N-[4-[4-(trifluoromethyl)phenyl]butyl]butanamide;hydrochloride

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CCN(CC1)CCCC(=O)NCCCCC2=CC=C(C=C2)C(F)(F)F.Cl

>  <Isomeric SMILES>
C1CCN(CC1)CCCC(=O)NCCCCC2=CC=C(C=C2)C(F)(F)F.Cl

>  <InChI Std. ID>
InChI=1S/C20H29F3N2O.ClH/c21-20(22,23)18-11-9-17(10-12-18)7-2-3-13-24-19(26)8-6-16-25-14-4-1-5-15-25;/h9-12H,1-8,13-16H2,(H,24,26);1H

>  <InChI Key>
AJYQWFZVLJWPER-UHFFFAOYSA-N

