2-[[2-氨基-6-[[4'-[(3-羧基-4-羟基苯基)偶氮]-3,3'-二甲氧基(1,1'-二苯基)-4-基]偶氮]-5-羟基-7-磺基-1-萘基]偶氮]-5-硝基苯甲酸三钠盐 ,6739-62-4 _ChemCD

2-[[2-氨基-6-[[4'-[(3-羧基-4-羟基苯基)偶氮]-3,3'-二甲氧基(1,1'-二苯基)-4-基]偶氮]-5-羟基-7-磺基-1-萘基]偶氮]-5-硝基苯甲酸三钠盐

basic_info
Product_Name：	2-[[2-氨基-6-[[4'-[(3-羧基-4-羟基苯基)偶氮]-3,3'-二甲氧基(1,1'-二苯基)-4-基]偶氮]-5-羟基-7-磺基-1-萘基]偶氮]-5-硝基苯甲酸三钠盐
CAS：	6739-62-4
中文同义词：	2-[[2-氨基-6-[[4'-[(3-羧基-4-羟基苯基)偶氮]-3,3'-二甲氧基(1,1'-二苯基)-4-基]偶氮]-5-羟基-7-磺基-1-萘基]偶氮]-5-硝基苯甲酸三钠盐
EnglishSynonyms：	BENZO CUPROLBLACK RLW ; TRISODIUM 2-[[2-AMINO-6-[[4'-[(3-CARBOXYLATO-4-HYDROXYPHENYL)AZO]-3,3'-DIMETHOXY[1,1'-BIPHENYL]-4-YL]AZO]-5-HYDROXY-7-SULPHONATO-1-NAPHTHYL]AZO]-5-NITROBENZOATE ; CI DIRECT BLACK 91 ; DIRECT BLACK 91
pro_mdlNumber：	MFCD00231280
pro_acceptors：	21
pro_donors：	3
pro_smile：	COc1cc(ccc1/N=N/c2ccc(c(c2)C(=O)[O-])O)c3ccc(c(c3)OC)/N=N/c4c(cc5c(c4O)ccc(c5/N=N/c6ccc(cc6C(=O)[O-])[N+](=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi：	InChI=1S/C38H28N8O13S.3Na/c1-58-31-13-18(3-9-28(31)42-40-20-5-12-30(47)25(15-20)38(51)52)19-4-10-29(32(14-19)59-2)43-45-35-33(60(55,56)57)17-23-22(36(35)48)7-8-26(39)34(23)44-41-27-11-6-21(46(53)54)16-24(27)37(49)50;;;/h3-17,47-48H,39H2,1-2H3,(H,49,50)(H,51,52)(H,55,56,57);;;/q;3*+1/p-3/b42-40+,44-41+,45-43+;;;
InChiKey：	InChIKey=QVYIFFPJPCUTHF-DTPVEEBPSA-K

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