基本信息 |
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产品名称: | CELECOXIB CARBOXYLIC ACID |
CAS: | 170571-01-4 |
英文同义词: | 4-[1-[4-(AMINOSULFONYL)PHENYL]-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-5-YL]BENZOIC ACID ; CARBOXYLIC ACID CELECOXIB ; CELEBREX CARBOXYLIC ACID ; CELECOXIB CARBOXYLIC ACID |
MDL号: | MFCD09840210 |
氢键受体数量: | 7 |
氢键供体数量: | 2 |
Smile: | c1cc(ccc1c2cn(nc2C(F)(F)F)c3ccc(cc3)S(=O)(=O)N)C(=O)O |
InChi: | InChI=1S/C17H12F3N3O4S/c18-17(19,20)15-14(10-1-3-11(4-2-10)16(24)25)9-23(22-15)12-5-7-13(8-6-12)28(21,26)27/h1-9H,(H,24,25)(H2,21,26,27) |
InChiKey: | InChIKey=FUQHYUZYGVIVLC-UHFFFAOYSA-N |
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