REACTIVE RED 4(17681-50-4) IR1
Product NameREACTIVE RED 4
CAS17681-50-4
Molecular FormulaC32H19ClN8Na4O14S4
Molecular Weight995.21
InChIInChI=1S/C32H23ClN8O14S4.4Na/c33-30-37-31(34-18-6-9-20(10-7-18)56(44,45)46)39-32(38-30)35-19-8-11-24(58(50,51)52)22(14-19)40-41-27-25(59(53,54)55)13-17-12-21(57(47,48)49)15-23(26(17)28(27)42)36-29(43)16-4-2-1-3-5-16;;;;/h1-15,42H,(H,36,43)(H,44,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H2,34,35,37,38,39);;;;/q;4*+1/p-4/b41-40+;;;;
InChIKey NUZJNUDPZLPKAR-CARHPIHDSA-J
SmilesC12C(O)=C(C(S([O-])(=O)=O)=CC=1C=C(S([O-])(=O)=O)C=C2NC(=O)C1C=CC=CC=1)/N=N/C1C=C(C=CC=1S([O-])(=O)=O)NC1=NC(=NC(NC2C=CC(S([O-])(=O)=O)=CC=2)=N1)Cl.[Na+].[Na+].[Na+].[Na+]
