2,2'-(1,2-ETHENDIYL)BIS(5-(4,6-DIPHENOXY)-2-(1,3,5-TRIAZINYLAMINO)BENZENESULFONIC ACID, DISODIUM SALT

CAS号
3654-76-0
CCD编号
CCD00070259
分子式
C44 H30 N8 O10 S2 . 2 Na
分子量
940.879

基本信息

产品名称: 2,2'-(1,2-ETHENDIYL)BIS(5-(4,6-DIPHENOXY)-2-(1,3,5-TRIAZINYLAMINO)BENZENESULFONIC ACID, DISODIUM SALT
CAS: 3654-76-0
英文同义词: 2,2'-(1,2-ETHENDIYL)BIS(5-(4,6-DIPHENOXY)-2-(1,3,5-TRIAZINYLAMINO)BENZENESULFONIC ACID, DISODIUM SALT
MDL号: MFCD00142254
氢键受体数量: 18
氢键供体数量: 2
Smile: c1ccc(cc1)Oc2nc(nc(n2)Oc3ccccc3)Nc4ccc(c(c4)S(=O)(=O)[O-])/C=C/c5ccc(cc5S(=O)(=O)[O-])Nc6nc(nc(n6)Oc7ccccc7)Oc8ccccc8.[Na+].[Na+]
InChi: InChI=1S/C44H32N8O10S2.2Na/c53-63(54,55)37-27-31(45-39-47-41(59-33-13-5-1-6-14-33)51-42(48-39)60-34-15-7-2-8-16-34)25-23-29(37)21-22-30-24-26-32(28-38(30)64(56,57)58)46-40-49-43(61-35-17-9-3-10-18-35)52-44(50-40)62-36-19-11-4-12-20-36;;/h1-28H,(H,53,54,55)(H,56,57,58)(H,45,47,48,51)(H,46,49,50,52);;/q;2*+1/p-2/b22-21+;;
InChiKey: InChIKey=YGFJSDANHIQEIG-ZPZFBZIMSA-L

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