
 CHEMBL1796029

 55 58  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL1796029

>  <PubChem CID>
53328116

>  <Formula>
C23H26ClN3O2

>  <Molecular Weight>
411.930000

>  <IUPAC Name>
1-[2-[4-(2-chlorophenyl)piperazin-1-yl]ethyl]-4-phenylpiperidine-2,6-dione

>  <XlogP>
3.2

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CN(CCN1CCN2C(=O)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4Cl

>  <Isomeric SMILES>
C1CN(CCN1CCN2C(=O)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4Cl

>  <InChI Std. ID>
InChI=1S/C23H26ClN3O2/c24-20-8-4-5-9-21(20)26-13-10-25(11-14-26)12-15-27-22(28)16-19(17-23(27)29)18-6-2-1-3-7-18/h1-9,19H,10-17H2

>  <InChI Key>
BNIMVTLJBJEXOC-UHFFFAOYSA-N

