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M  END

>  <Chemical Name>
protriptyline

>  <PubChem CID>
4976

>  <Formula>
C19H21N

>  <Molecular Weight>
263.384000

>  <IUPAC Name>
3-(11H-dibenzo[1,2-a:1',2'-e][7]annulen-11-yl)-N-methylpropan-1-amine

>  <XlogP>
4.4

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
CNCCCC1C2=CC=CC=C2C=CC3=CC=CC=C13

>  <Isomeric SMILES>
CNCCCC1C2=CC=CC=C2C=CC3=CC=CC=C13

>  <InChI Std. ID>
InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3

>  <InChI Key>
BWPIARFWQZKAIA-UHFFFAOYSA-N

