
 CHEMBL268197

 43 45  0  0  0  0  0  0  0  0999 V2000
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    1.7265    2.1184    0.3263 C   0  0  0  0  0
    1.9152    3.1416   -0.6745 N   0  0  0  0  0
    1.6182    4.4595   -0.4071 C   0  0  0  0  0
    1.2214    4.8599    0.6816 O   0  0  0  0  0
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    2.8106    6.1054   -3.6258 C   0  0  0  0  0
    2.0573    7.2795   -3.6054 C   0  0  0  0  0
    1.1778    7.5355   -2.5555 C   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL268197

>  <PubChem CID>
44265934

>  <Formula>
C22H18ClNO

>  <Molecular Weight>
347.842000

>  <IUPAC Name>
4-chloro-N-(3,3-diphenylprop-2-enyl)benzamide

>  <XlogP>
5.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
C1=CC=C(C=C1)C(=CCNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

>  <Isomeric SMILES>
C1=CC=C(C=C1)C(=CCNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

>  <InChI Std. ID>
InChI=1S/C22H18ClNO/c23-20-13-11-19(12-14-20)22(25)24-16-15-21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-15H,16H2,(H,24,25)

>  <InChI Key>
BNKPMAVKOSNGEL-UHFFFAOYSA-N

