basic_info |
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| Product_Name: | 8-(3-METHYLBUTOXY)-3-(1H-TETRAZOL-5-YL)-2H-1-BENZOPYRAN-2-ONE |
| CAS: | 76239-31-1 |
| EnglishSynonyms: | 8-(3-METHYLBUTOXY)-3-(1H-TETRAZOL-5-YL)-2H-1-BENZOPYRAN-2-ONE |
| pro_mdlNumber: | MFCD01762860 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | CC(C)CCOc1cccc2c1oc(=O)c(c2)c3[nH]nnn3 |
| InChi: | InChI=1S/C15H16N4O3/c1-9(2)6-7-21-12-5-3-4-10-8-11(14-16-18-19-17-14)15(20)22-13(10)12/h3-5,8-9H,6-7H2,1-2H3,(H,16,17,18,19) |
| InChiKey: | InChIKey=CPDXABQMCZMDKE-UHFFFAOYSA-N |
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