
 JWH-182

 58 61  0  0  0  0  0  0  0  0999 V2000
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    2.0339    1.7510   -1.2289 H   0  0  0  0  0
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    9.5623   -0.1194    1.6060 H   0  0  0  0  0
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M  END

>  <Chemical Name>
JWH-182

>  <PubChem CID>
45268702

>  <Formula>
C27H29NO

>  <Molecular Weight>
383.535000

>  <IUPAC Name>
(1-pentylindol-3-yl)-(4-propylnaphthalen-1-yl)methanone

>  <XlogP>
7.7

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=C(C4=CC=CC=C43)CCC

>  <Isomeric SMILES>
CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=C(C4=CC=CC=C43)CCC

>  <InChI Std. ID>
InChI=1S/C27H29NO/c1-3-5-10-18-28-19-25(23-14-8-9-15-26(23)28)27(29)24-17-16-20(11-4-2)21-12-6-7-13-22(21)24/h6-9,12-17,19H,3-5,10-11,18H2,1-2H3

>  <InChI Key>
AKGUMDFQXWZHHS-UHFFFAOYSA-N

