
 CHEMBL38634

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    5.4549    1.0526    0.3954 H   0  0  0  0  0
    4.3397   -1.0480   -0.2726 H   0  0  0  0  0
  1  2  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL38634

>  <PubChem CID>
10661409

>  <Formula>
C20H23NO

>  <Molecular Weight>
293.410000

>  <IUPAC Name>
1'-benzylspiro[3,4-dihydrochromene-2,4'-piperidine]

>  <XlogP>
4.200

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1CC2(CCN(CC2)CC3=CC=CC=C3)OC4=CC=CC=C41

>  <Isomeric SMILES>
C1CC2(CCN(CC2)CC3=CC=CC=C3)OC4=CC=CC=C41

>  <InChI Std. ID>
InChI=1S/C20H23NO/c1-2-6-17(7-3-1)16-21-14-12-20(13-15-21)11-10-18-8-4-5-9-19(18)22-20/h1-9H,10-16H2

>  <InChI Key>
CRKWADRIYCMTBU-UHFFFAOYSA-N

