
 CHEMBL354210

 56 59  0  0  0  0  0  0  0  0999 V2000
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    0.1485   -3.1425    4.1781 C   0  0  0  0  0
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   -3.3556   -1.2310   -5.1021 C   0  0  0  0  0
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  3 11  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL354210

>  <PubChem CID>
9998826

>  <Formula>
C23H29N3O

>  <Molecular Weight>
363.505000

>  <IUPAC Name>
N-[2-[4-(1,2,3,4-tetrahydronaphthalen-1-yl)piperazin-1-yl]ethyl]benzamide

>  <XlogP>
3.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
C1CC(C2=CC=CC=C2C1)N3CCN(CC3)CCNC(=O)C4=CC=CC=C4

>  <Isomeric SMILES>
C1CC(C2=CC=CC=C2C1)N3CCN(CC3)CCNC(=O)C4=CC=CC=C4

>  <InChI Std. ID>
InChI=1S/C23H29N3O/c27-23(20-8-2-1-3-9-20)24-13-14-25-15-17-26(18-16-25)22-12-6-10-19-7-4-5-11-21(19)22/h1-5,7-9,11,22H,6,10,12-18H2,(H,24,27)

>  <InChI Key>
GFORNYWGPFXWHV-UHFFFAOYSA-N

