
 CHEMBL277661

 46 49  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL277661

>  <PubChem CID>
44458112

>  <Formula>
C22H18N2O4

>  <Molecular Weight>
374.396000

>  <IUPAC Name>
(3S,4S)-4-(naphthalene-2-carbonylamino)-5-oxo-1-phenylpyrrolidine-3-carboxylic acid

>  <XlogP>
3.4

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1C(C(C(=O)N1C2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)C(=O)O

>  <Isomeric SMILES>
C1[C@@H]([C@@H](C(=O)N1C2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)C(=O)O

>  <InChI Std. ID>
InChI=1S/C22H18N2O4/c25-20(16-11-10-14-6-4-5-7-15(14)12-16)23-19-18(22(27)28)13-24(21(19)26)17-8-2-1-3-9-17/h1-12,18-19H,13H2,(H,23,25)(H,27,28)/t18-,19-/m0/s1

>  <InChI Key>
BDVFAVBKAXMDIW-OALUTQOASA-N

