
 SCHEMBL14149623

 50 53  0  0  0  0  0  0  0  0999 V2000
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   -0.6790   -1.6434    2.7718 C   0  0  0  0  0
   -1.1395   -0.3479    2.6000 C   0  0  0  0  0
   -3.9261    1.7689    1.6513 C   0  0  0  0  0
   -4.1636    2.3841    0.2548 C   0  0  0  0  0
   -5.5489    2.8494    0.0263 N   0  0  0  0  0
   -5.9246    4.0220    0.8445 C   0  0  0  0  0
   -5.2648    5.3369    0.3983 C   0  0  0  0  0
   -5.5457    5.6207   -0.9776 O   0  0  0  0  0
   -5.1088    4.5435   -1.8261 C   0  0  0  0  0
   -5.7602    3.2030   -1.3983 C   0  0  0  0  0
   -5.4944    4.8912   -3.2694 C   0  0  0  0  0
   -5.0238    3.8606   -4.1411 O   0  0  0  0  0
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   -6.3035    2.2112   -7.0917 C   0  0  0  0  0
   -7.0254    3.2476   -7.6643 C   0  0  0  0  0
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   -6.4300    4.6982   -5.9755 C   0  0  0  0  0
   -6.2529    0.6610   -7.8263 Cl  0  0  0  0  0
    0.3280    1.1979    2.5529 H   0  0  0  0  0
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    0.1942   -1.8528    3.3801 H   0  0  0  0  0
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   -4.1800    5.3222    0.5513 H   0  0  0  0  0
   -4.0161    4.4636   -1.7646 H   0  0  0  0  0
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   -7.5770    3.1074   -8.5891 H   0  0  0  0  0
   -6.5011    5.7140   -5.5985 H   0  0  0  0  0
  1  9  1  0  0  0
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M  END

>  <Chemical Name>
SCHEMBL14149623

>  <PubChem CID>
71086303

>  <Formula>
C20H24ClN3O2

>  <Molecular Weight>
373.881000

>  <IUPAC Name>
(2R)-2-[(5-chloropyridin-3-yl)oxymethyl]-4-[2-(2,3-dihydroindol-1-yl)ethyl]morpholine

>  <XlogP>
3.0

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CN(C2=CC=CC=C21)CCN3CCOC(C3)COC4=CC(=CN=C4)Cl

>  <Isomeric SMILES>
C1CN(C2=CC=CC=C21)CCN3CCO[C@H](C3)COC4=CC(=CN=C4)Cl

>  <InChI Std. ID>
InChI=1S/C20H24ClN3O2/c21-17-11-18(13-22-12-17)26-15-19-14-23(9-10-25-19)7-8-24-6-5-16-3-1-2-4-20(16)24/h1-4,11-13,19H,5-10,14-15H2/t19-/m1/s1

>  <InChI Key>
QURJBQQAYVMKHZ-LJQANCHMSA-N

