
 SCHEMBL3928733

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M  END

>  <Chemical Name>
SCHEMBL3928733

>  <PubChem CID>
24769071

>  <Formula>
C26H29NO5

>  <Molecular Weight>
435.520000

>  <IUPAC Name>
2,4-dimethyl-2-[[1-(2-phenoxyethoxy)naphthalene-2-carbonyl]amino]pentanoic acid

>  <XlogP>
5.6

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC(C)CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCCOC3=CC=CC=C3

>  <Isomeric SMILES>
CC(C)CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCCOC3=CC=CC=C3

>  <InChI Std. ID>
InChI=1S/C26H29NO5/c1-18(2)17-26(3,25(29)30)27-24(28)22-14-13-19-9-7-8-12-21(19)23(22)32-16-15-31-20-10-5-4-6-11-20/h4-14,18H,15-17H2,1-3H3,(H,27,28)(H,29,30)

>  <InChI Key>
ANNXRMWDEFSBDZ-UHFFFAOYSA-N

