basic_info |
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| Product_Name: | 3-([(6-HYDROXY-2H-1,3-BENZODIOXOL-5-YL)METHYL]AMINO)PENTANENITRILE |
| EnglishSynonyms: | 3-([(6-HYDROXY-2H-1,3-BENZODIOXOL-5-YL)METHYL]AMINO)PENTANENITRILE |
| pro_mdlNumber: | MFCD17517660 |
| pro_acceptors: | 5 |
| pro_donors: | 2 |
| pro_smile: | CCC(CC#N)NCc1cc2c(cc1O)OCO2 |
| InChi: | InChI=1S/C13H16N2O3/c1-2-10(3-4-14)15-7-9-5-12-13(6-11(9)16)18-8-17-12/h5-6,10,15-16H,2-3,7-8H2,1H3 |
| InChiKey: | InChIKey=WWAMKRJEAXMIJY-UHFFFAOYSA-N |
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