basic_info |
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| Product_Name: | 3-(4-CHLOROPHENYL)-5-(2-NITROPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER |
| CAS: | 1188243-87-9 |
| EnglishSynonyms: | 3-(4-CHLOROPHENYL)-5-(2-NITROPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER |
| pro_mdlNumber: | MFCD17183419 |
| pro_acceptors: | 7 |
| pro_donors: | 0 |
| pro_smile: | CCOC(=O)c1c(noc1c2ccccc2[N+](=O)[O-])c3ccc(cc3)Cl |
| InChi: | InChI=1S/C18H13ClN2O5/c1-2-25-18(22)15-16(11-7-9-12(19)10-8-11)20-26-17(15)13-5-3-4-6-14(13)21(23)24/h3-10H,2H2,1H3 |
| InChiKey: | InChIKey=KQKNCDJGGRGZQQ-UHFFFAOYSA-N |
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