
 SR-02000000326

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M  END

>  <Chemical Name>
SR-02000000326

>  <PubChem CID>
44640168

>  <Formula>
C18H22ClN3O3

>  <Molecular Weight>
363.842000

>  <IUPAC Name>
(1-anilino-1-oxopropan-2-yl) 5-chloro-3-methyl-1-(2-methylpropyl)pyrazole-4-carboxylate

>  <XlogP>
4.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1=NN(C(=C1C(=O)OC(C)C(=O)NC2=CC=CC=C2)Cl)CC(C)C

>  <Isomeric SMILES>
CC1=NN(C(=C1C(=O)OC(C)C(=O)NC2=CC=CC=C2)Cl)CC(C)C

>  <InChI Std. ID>
InChI=1S/C18H22ClN3O3/c1-11(2)10-22-16(19)15(12(3)21-22)18(24)25-13(4)17(23)20-14-8-6-5-7-9-14/h5-9,11,13H,10H2,1-4H3,(H,20,23)

>  <InChI Key>
BAKKVYJMCVFBLD-UHFFFAOYSA-N

