7-氨基-4-羟基-3-[[2-甲氧基-5-甲基 -4-[[2-(磺基氧基)乙基]磺酰基]苯基]偶氮]-8-[[2-磺基-4-[[2-(磺基氧基)乙基]磺酰基]苯基]偶氮]-2-萘磺酸四钠盐

2-Naphthalenesulfonic acid, 7-amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-8-[2-[2-sulfo-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:4) · CAS 503155-49-5

中文名: 7-氨基-4-羟基-3-[[2-甲氧基-5-甲基 -4-[[2-(磺基氧基)乙基]磺酰基]苯基]偶氮]-8-[[2-磺基-4-[[2-(磺基氧基)乙基]磺酰基]苯基]偶氮]-2-萘磺酸四钠盐
中文别名: 暂无
英文名: 2-Naphthalenesulfonic acid, 7-amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-8-[2-[2-sulfo-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:4)
CAS: 503155-49-5
CID: 165364854
IUPAC 名称: tetrasodium;7-amino-4-hydroxy-3-[[2-methoxy-5-methyl-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]-8-[[2-sulfonato-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonate

名称与编号

中文名: 7-氨基-4-羟基-3-[[2-甲氧基-5-甲基 -4-[[2-(磺基氧基)乙基]磺酰基]苯基]偶氮]-8-[[2-磺基-4-[[2-(磺基氧基)乙基]磺酰基]苯基]偶氮]-2-萘磺酸四钠盐
中文别名: 暂无
英文名: 2-Naphthalenesulfonic acid, 7-amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-8-[2-[2-sulfo-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:4)
CAS: 503155-49-5
CID: 165364854
IUPAC 名称: tetrasodium;7-amino-4-hydroxy-3-[[2-methoxy-5-methyl-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]-8-[[2-sulfonato-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonate

分子属性

分子式: C28H25N5Na4O20S6
分子量: 1035.9 g/mol
精确质量: 1034.9007924 Da
单同位素质量: 1034.9007924 Da
XLogP: 暂无
极性表面积: 471 Å²
氢键供体: 2
氢键受体: 25
可旋转键: 13
重原子数: 63
净电荷: 0
结构复杂度: 2140

结构标识

InChIKey: CKQJXRWPKNTQSO-UHFFFAOYSA-J
SMILES: CC1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)[O-])OC)N=NC2=C(C=C3C(=C2O)C=CC(=C3N=NC4=C(C=C(C=C4)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
InChI: InChI=1S/C28H29N5O20S6.4Na/c1-15-11-21(22(51-2)14-23(15)55(37,38)10-8-53-59(48,49)50)31-33-27-25(57(42,43)44)13-18-17(28(27)34)4-5-19(29)26(18)32-30-20-6-3-16(12-24(20)56(39,40)41)54(35,36)9-7-52-58(45,46)47;;;;/h3-6,11-14,34H,7-10,29H2,1-2H3,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50);;;;/q;4*+1/p-4