
 NSC697154

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M  END

>  <Chemical Name>
NSC697154

>  <PubChem CID>
394036

>  <Formula>
C26H30N4O4

>  <Molecular Weight>
462.550000

>  <IUPAC Name>
2-(phenoxymethyl)-5-[8-[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]octyl]-1,3,4-oxadiazole

>  <XlogP>
5.7

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
C1=CC=C(C=C1)OCC2=NN=C(O2)CCCCCCCCC3=NN=C(O3)COC4=CC=CC=C4

>  <Isomeric SMILES>
C1=CC=C(C=C1)OCC2=NN=C(O2)CCCCCCCCC3=NN=C(O3)COC4=CC=CC=C4

>  <InChI Std. ID>
InChI=1S/C26H30N4O4/c1(3-11-17-23-27-29-25(33-23)19-31-21-13-7-5-8-14-21)2-4-12-18-24-28-30-26(34-24)20-32-22-15-9-6-10-16-22/h5-10,13-16H,1-4,11-12,17-20H2

>  <InChI Key>
GVGJLPSKXHDGIR-UHFFFAOYSA-N

