
 SCHEMBL708247

 63 65  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL708247

>  <PubChem CID>
66774954

>  <Formula>
C27H29NO6

>  <Molecular Weight>
463.530000

>  <IUPAC Name>
2-[4-[[(3,5-dimethoxy-4-methylbenzoyl)-(2-phenylethyl)amino]methyl]phenoxy]acetic acid

>  <XlogP>
4.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC1=C(C=C(C=C1OC)C(=O)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)OCC(=O)O)OC

>  <Isomeric SMILES>
CC1=C(C=C(C=C1OC)C(=O)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)OCC(=O)O)OC

>  <InChI Std. ID>
InChI=1S/C27H29NO6/c1-19-24(32-2)15-22(16-25(19)33-3)27(31)28(14-13-20-7-5-4-6-8-20)17-21-9-11-23(12-10-21)34-18-26(29)30/h4-12,15-16H,13-14,17-18H2,1-3H3,(H,29,30)

>  <InChI Key>
FDORZHLISAVKJL-UHFFFAOYSA-N

