basic_info |
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| Product_Name： | 4-氧杂-8-氮杂三环[5.1.0.03,5]辛烷(9CI) |
| CAS： | 82956-02-3 |
| 中文同义词： | 4-氧杂-8-氮杂三环[5.1.0.03,5]辛烷(9CI) |
| EnglishSynonyms： | 6-AMIDINO-2-NAPHTHYL-4-AMINOMETHYLBENZOATE DIMETHANESULFONATE |
| pro_mdlNumber： | MFCD01766304 |
| pro_acceptors： | 5 |
| pro_donors： | 3 |
| pro_smile： | CS(=O)(=O)O.CS(=O)(=O)O.c1cc(ccc1CN)C(=O)Oc2ccc3cc(ccc3c2)C(=N)N |
| InChi： | InChI=1S/C19H17N3O2.2CH4O3S/c20-11-12-1-3-13(4-2-12)19(23)24-17-8-7-14-9-16(18(21)22)6-5-15(14)10-17;2*1-5(2,3)4/h1-10H,11,20H2,(H3,21,22);2*1H3,(H,2,3,4) |
| InChiKey： | InChIKey=IKHXKNHEMGSPQB-UHFFFAOYSA-N |
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English![4-氧杂-8-氮杂三环[5.1.0.03,5]辛烷(9CI)](http://www.chemcd.com/createImage?smile=CS%28%3DO%29%28%3DO%29O.CS%28%3DO%29%28%3DO%29O.c1cc%28ccc1CN%29C%28%3DO%29Oc2ccc3cc%28ccc3c2%29C%28%3DN%29N&size=web.jpg)