Basic Information |
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| Product Name： | PIROLATE |
| CAS： | 55149-05-8 |
| English Synonyms： | PIROLATE |
| MDL Number.： | MFCD00864794 |
| H bond acceptor： | 8 |
| H bond donor： | 1 |
| Smile： | CCOC(=O)c1[nH]c2c(cc3cc(c(cc3n2)OC)OC)c(=O)n1 |
| InChi： | InChI=1S/C16H15N3O5/c1-4-24-16(21)14-18-13-9(15(20)19-14)5-8-6-11(22-2)12(23-3)7-10(8)17-13/h5-7H,4H2,1-3H3,(H,17,18,19,20) |
| InChiKey： | InChIKey=KIDJDJMACBOHKQ-UHFFFAOYSA-N |
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