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Amb566793

Duplicate ID
Molecule Name diethyl 2-(4-(2-(pyridin-3-yl)piperidin-1-yl)but-2-yn-1-yl)malonate
SmilesCCOC(=O)C(C(=O)OCC)CC#CCN1CCCCC1c1cccnc1
InchiKeyBJQPESVQPROFRD-UHFFFAOYSA-N
InChi InChI=1S/C21H28N2O4/c1-3-26-20(24)18(21(25)27-4-2)11-5-7-14-23-15-8-6-12-19(23)17-10-9-13-22-16-17/h9-10,13,16,18-19H,3-4,6,8,11-12,14-15H2,1-2H3
Formula C21H28N2O4
Molecular weight 372.458
Rings 2
logP 2.6824
PSA 68.73
MR 106.737
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