basic_info |
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Product_Name: | 1H-INDAZOLE-3-CARBOXYLIC ACID, 2-[(2-CYANOETHYL)AMINO]-2-OXOETHYL ESTER |
CAS: | 938707-60-9 |
EnglishSynonyms: | 1H-INDAZOLE-3-CARBOXYLIC ACID, 2-[(2-CYANOETHYL)AMINO]-2-OXOETHYL ESTER |
pro_mdlNumber: | MFCD09486432 |
pro_acceptors: | 7 |
pro_donors: | 2 |
pro_smile: | c1ccc2c(c1)c(n[nH]2)C(=O)OCC(=O)NCCC#N |
InChi: | InChI=1S/C13H12N4O3/c14-6-3-7-15-11(18)8-20-13(19)12-9-4-1-2-5-10(9)16-17-12/h1-2,4-5H,3,7-8H2,(H,15,18)(H,16,17) |
InChiKey: | InChIKey=MYKUFEDIMHCINZ-UHFFFAOYSA-N |
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