
 CHEMBL3978642

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M  END

>  <Chemical Name>
CHEMBL3978642

>  <PubChem CID>
134151427

>  <Formula>
C20H22ClNO

>  <Molecular Weight>
327.852000

>  <IUPAC Name>
2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2,3-dihydroinden-1-one;hydrochloride

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1CN(CC2=CC=CC=C21)CCC3CC4=CC=CC=C4C3=O.Cl

>  <Isomeric SMILES>
C1CN(CC2=CC=CC=C21)CCC3CC4=CC=CC=C4C3=O.Cl

>  <InChI Std. ID>
InChI=1S/C20H21NO.ClH/c22-20-17(13-16-6-3-4-8-19(16)20)10-12-21-11-9-15-5-1-2-7-18(15)14-21;/h1-8,17H,9-14H2;1H

>  <InChI Key>
CPHLFSOSYDLNIN-UHFFFAOYSA-N

