
 LY86057

 51 54  0  0  0  0  0  0  0  0999 V2000
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    1.3730   -8.4051   -1.5325 C   0  0  0  0  0
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    2.6219  -11.2899   -4.2987 C   0  0  0  0  0
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M  END

>  <Chemical Name>
LY86057

>  <PubChem CID>
13878025

>  <Formula>
C20H26N2O3

>  <Molecular Weight>
342.439000

>  <IUPAC Name>
3-hydroxybutan-2-yl 7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxylate

>  <XlogP>
2.4

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC(C(C)OC(=O)C1CC2C(CC3=CNC4=CC=CC2=C34)N(C1)C)O

>  <Isomeric SMILES>
CC(C(C)OC(=O)C1CC2C(CC3=CNC4=CC=CC2=C34)N(C1)C)O

>  <InChI Std. ID>
InChI=1S/C20H26N2O3/c1-11(23)12(2)25-20(24)14-7-16-15-5-4-6-17-19(15)13(9-21-17)8-18(16)22(3)10-14/h4-6,9,11-12,14,16,18,21,23H,7-8,10H2,1-3H3

>  <InChI Key>
GOHDSZGHAHFEHG-UHFFFAOYSA-N

