基本信息 |
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产品名称: | 4H-1-苯并吡喃-6-乙酸,2-(4-氯苯基)-α-乙基-3-甲氧杂 y-4-羰基-,甲基酯 |
CAS: | 75219-46-4 |
中文同义词: | 4H-1-苯并吡喃-6-乙酸,2-(4-氯苯基)-α-乙基-3-甲氧杂 y-4-羰基-,甲基酯 |
英文同义词: | ATRIMUSTINE |
MDL号: | MFCD00866413 |
氢键受体数量: | 7 |
氢键供体数量: | 0 |
Smile: | C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)COC(=O)CCCc5ccc(cc5)N(CCCl)CCCl)OC(=O)c6ccccc6 |
InChi: | InChI=1S/C41H47Cl2NO6/c1-41-21-20-34-33-17-15-32(49-40(47)29-7-3-2-4-8-29)26-30(33)12-16-35(34)36(41)18-19-37(41)50-39(46)27-48-38(45)9-5-6-28-10-13-31(14-11-28)44(24-22-42)25-23-43/h2-4,7-8,10-11,13-15,17,26,34-37H,5-6,9,12,16,18-25,27H2,1H3/t34-,35-,36+,37+,41+/m1/s1 |
InChiKey: | InChIKey=IFJUINDAXYAPTO-UUBSBJJBSA-N |
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