
 CHEMBL121799

 54 57  0  0  0  0  0  0  0  0999 V2000
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    3.4759   -2.8311   -0.1336 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL121799

>  <PubChem CID>
10524003

>  <Formula>
C23H27ClN2O

>  <Molecular Weight>
382.932000

>  <IUPAC Name>
2-[(4-chlorophenoxy)methyl]-1-methyl-3-(2-piperidin-1-ylethyl)indole

>  <XlogP>
5.3

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)CCN4CCCCC4

>  <Isomeric SMILES>
CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)CCN4CCCCC4

>  <InChI Std. ID>
InChI=1S/C23H27ClN2O/c1-25-22-8-4-3-7-20(22)21(13-16-26-14-5-2-6-15-26)23(25)17-27-19-11-9-18(24)10-12-19/h3-4,7-12H,2,5-6,13-17H2,1H3

>  <InChI Key>
CUILOIKYNXRMEP-UHFFFAOYSA-N

