[(9,10-二氢-9,10-二氧代-1,4-蒽二基)二亚氨基]双(乙基甲基)-苯磺酸二钠盐

CAS号
83027-61-6
CCD编号
CCD08276093
分子式
C32 H28 N2 O9 S2 . 2 Na
分子量
694.69

基本信息

产品名称: [(9,10-二氢-9,10-二氧代-1,4-蒽二基)二亚氨基]双(乙基甲基)-苯磺酸二钠盐
CAS: 83027-61-6
中文同义词: [(9,10-二氢-9,10-二氧代-1,4-蒽二基)二亚氨基]双(乙基甲基)-苯磺酸二钠盐
英文同义词: DISODIUM [(9,10-DIHYDRO-9,10-DIOXO-1,4-ANTHRYLENE)DIIMINO]BIS[ETHYLTOLUENESULPHONATE]
MDL号: MFCD23160592
氢键受体数量: 11
氢键供体数量: 3
Smile: CCc1cc(c(cc1C)S(=O)(=O)[O-])Nc2ccc(c3c2C(=O)c4c(cccc4O)C3=O)Nc5cc(c(cc5S(=O)(=O)[O-])CC)C.[Na+].[Na+]
InChi: InChI=1S/C32H30N2O9S2.2Na/c1-5-18-14-24(26(13-17(18)4)44(38,39)40)34-22-11-10-21(33-23-12-16(3)19(6-2)15-27(23)45(41,42)43)29-30(22)32(37)28-20(31(29)36)8-7-9-25(28)35;;/h7-15,33-35H,5-6H2,1-4H3,(H,38,39,40)(H,41,42,43);;/q;2*+1/p-2
InChiKey: InChIKey=HXYQJJMDOFWPNY-UHFFFAOYSA-L

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