
 BDBM50359434

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M  END

>  <Chemical Name>
BDBM50359434

>  <PubChem CID>
91930426

>  <Formula>
C20H25N3O3

>  <Molecular Weight>
355.438000

>  <IUPAC Name>
2-[(E)-4-(3,4-dihydro-2H-chromen-2-ylmethylamino)but-2-enyl]-1-hydroxy-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-one

>  <XlogP>
1.8

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CC2=C(N(C(=O)N2C1)CC=CCNCC3CCC4=CC=CC=C4O3)O

>  <Isomeric SMILES>
C1CC2=C(N(C(=O)N2C1)C/C=C/CNCC3CCC4=CC=CC=C4O3)O

>  <InChI Std. ID>
InChI=1S/C20H25N3O3/c24-19-17-7-5-13-22(17)20(25)23(19)12-4-3-11-21-14-16-10-9-15-6-1-2-8-18(15)26-16/h1-4,6,8,16,21,24H,5,7,9-14H2/b4-3+

>  <InChI Key>
CXIGAAUKJDPSQU-ONEGZZNKSA-N

