
 CHEMBL2346783

 66 69  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL2346783

>  <PubChem CID>
25175471

>  <Formula>
C31H30N2O3

>  <Molecular Weight>
478.592000

>  <IUPAC Name>
methyl 3-[[benzyl(3,3-diphenylpropyl)carbamoyl]amino]benzoate

>  <XlogP>
6.2

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
COC(=O)C1=CC(=CC=C1)NC(=O)N(CCC(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=CC=C4

>  <Isomeric SMILES>
COC(=O)C1=CC(=CC=C1)NC(=O)N(CCC(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=CC=C4

>  <InChI Std. ID>
InChI=1S/C31H30N2O3/c1-36-30(34)27-18-11-19-28(22-27)32-31(35)33(23-24-12-5-2-6-13-24)21-20-29(25-14-7-3-8-15-25)26-16-9-4-10-17-26/h2-19,22,29H,20-21,23H2,1H3,(H,32,35)

>  <InChI Key>
CXXMOYDDXQAZNI-UHFFFAOYSA-N

