Molecular Structure:
CCD No.:CCD00447131
SYNTHON-LAB SL035744
Formula:C25 H21 N3 O6
MolWeight:459.456
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| Product Name： | SYNTHON-LAB SL035744 |
| English Synonyms： | SYNTHON-LAB SL035744 |
| MDL Number.： | MFCD04087256 |
| H bond acceptor： | 9 |
| H bond donor： | 3 |
| Smile： | Cc1cc(c(n1c2cc(cc(c2)C(=O)O)C(=O)O)C)/C=C(\C#N)/C(=O)Nc3cccc(c3)OC |
| InChi： | InChI=1S/C25H21N3O6/c1-14-7-16(8-19(13-26)23(29)27-20-5-4-6-22(12-20)34-3)15(2)28(14)21-10-17(24(30)31)9-18(11-21)25(32)33/h4-12H,1-3H3,(H,27,29)(H,30,31)(H,32,33)/b19-8+ |
| InChiKey： | InChIKey=KHAZNSNAYQYKTH-UFWORHAWSA-N |
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