basic_info |
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| Product_Name: | 3-[1-(3-BROMOPHENYL)-3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-4-YL]PROPANOIC ACID |
| EnglishSynonyms: | 3-[1-(3-BROMOPHENYL)-3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-4-YL]PROPANOIC ACID |
| pro_mdlNumber: | MFCD13345001 |
| pro_acceptors: | 5 |
| pro_donors: | 1 |
| pro_smile: | CC1=NN(C(=O)C1CCC(=O)O)c2cccc(c2)Br |
| InChi: | InChI=1S/C13H13BrN2O3/c1-8-11(5-6-12(17)18)13(19)16(15-8)10-4-2-3-9(14)7-10/h2-4,7,11H,5-6H2,1H3,(H,17,18) |
| InChiKey: | InChIKey=NOHBZOYBOPINNE-UHFFFAOYSA-N |
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