
 MLS000093376

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M  END

>  <Chemical Name>
MLS000093376

>  <PubChem CID>
3244629

>  <Formula>
C19H29N3O3

>  <Molecular Weight>
347.459000

>  <IUPAC Name>
N-[3-[butyl(ethyl)amino]propyl]-2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetamide

>  <XlogP>
2.2

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCCCN(CC)CCCNC(=O)CC1C(=O)NC2=CC=CC=C2O1

>  <Isomeric SMILES>
CCCCN(CC)CCCNC(=O)CC1C(=O)NC2=CC=CC=C2O1

>  <InChI Std. ID>
InChI=1S/C19H29N3O3/c1-3-5-12-22(4-2)13-8-11-20-18(23)14-17-19(24)21-15-9-6-7-10-16(15)25-17/h6-7,9-10,17H,3-5,8,11-14H2,1-2H3,(H,20,23)(H,21,24)

>  <InChI Key>
IYBVMICTDCGOGB-UHFFFAOYSA-N

