Basic Information |
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| Product Name： | AURORA 13458 |
| English Synonyms： | AURORA 13458 |
| MDL Number.： | MFCD02350189 |
| H bond acceptor： | 4 |
| H bond donor： | 1 |
| Smile： | CC1=CC=C(\C=C(/C#N)C2=NC3=CC=CC=C3C(=O)N2)C=C1 |
| InChi： | InChI=1S/C18H13N3O/c1-12-6-8-13(9-7-12)10-14(11-19)17-20-16-5-3-2-4-15(16)18(22)21-17/h2-10H,1H3,(H,20,21,22)/b14-10+ |
| InChiKey： | InChIKey=PYIIRKHMTUYKJM-GXDHUFHOSA-N |
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