basic_info |
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| Product_Name: | 5-(4-CHLOROPHENYL)-3-(3-NITROPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER |
| CAS: | 1188187-57-6 |
| EnglishSynonyms: | 5-(4-CHLOROPHENYL)-3-(3-NITROPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER |
| pro_mdlNumber: | MFCD17182689 |
| pro_acceptors: | 7 |
| pro_donors: | 0 |
| pro_smile: | CCOC(=O)c1c(noc1c2ccc(cc2)Cl)c3cccc(c3)[N+](=O)[O-] |
| InChi: | InChI=1S/C18H13ClN2O5/c1-2-25-18(22)15-16(12-4-3-5-14(10-12)21(23)24)20-26-17(15)11-6-8-13(19)9-7-11/h3-10H,2H2,1H3 |
| InChiKey: | InChIKey=VPYSWYIHEJSITE-UHFFFAOYSA-N |
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