
 CHEMBL3596460

 63 67  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL3596460

>  <PubChem CID>
24782658

>  <Formula>
C30H28F3NO

>  <Molecular Weight>
475.555000

>  <IUPAC Name>
4-[[3-naphthalen-1-yl-5-(trifluoromethyl)phenyl]methoxymethyl]-4-phenylpiperidine

>  <XlogP>
7.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CNCCC1(COCC2=CC(=CC(=C2)C3=CC=CC4=CC=CC=C43)C(F)(F)F)C5=CC=CC=C5

>  <Isomeric SMILES>
C1CNCCC1(COCC2=CC(=CC(=C2)C3=CC=CC4=CC=CC=C43)C(F)(F)F)C5=CC=CC=C5

>  <InChI Std. ID>
InChI=1S/C30H28F3NO/c31-30(32,33)26-18-22(17-24(19-26)28-12-6-8-23-7-4-5-11-27(23)28)20-35-21-29(13-15-34-16-14-29)25-9-2-1-3-10-25/h1-12,17-19,34H,13-16,20-21H2

>  <InChI Key>
SSAVZJUOGAUDHO-UHFFFAOYSA-N

