Sodium 5-({4-Chloro-6-[Ethyl(Phenyl)Amino]-1,3,5-Triazin-2-Yl}Amino)-3-({5-[(2,3-Dibromopropanoyl)Amino]-2-Sulfophenyl}Diazenyl)-4-Hydroxy-7-Sulfo-2-Naphthalenesulfonate
[CAS# 155522-14-8]

Identification

• Name: Sodium 5-({4-Chloro-6-[Ethyl(Phenyl)Amino]-1,3,5-Triazin-2-Yl}Amino)-3-({5-[(2,3-Dibromopropanoyl)Amino]-2-Sulfophenyl}Diazenyl)-4-Hydroxy-7-Sulfo-2-Naphthalenesulfonate
• Synonyms: 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-(ethylphenylamino)-1,3,5-triazin-2-yl]amino]-3-[[5-[(2,3-dibromo-1-oxopropyl)amino]-2-sulfophenyl]azo]-4-hydroxy-, sodium salt
• Molecular Formula: C₃₀H₂₄Br₂ClN₈NaO₁₁S₃
• Molecular Weight: 987.00
• CAS Registry Number: 155522-14-8
• SMILES: CCN(c1ccccc1)c2nc(nc(n2)Cl)Nc3cc(cc4c3c(c(c(c4)S(=O)(=O)[O-])N=Nc5cc(ccc5S(=O)(=O)O)NC(=O)C(CBr)Br)O)S(=O)(=O)O.[Na+]
• InChI: 1S/C30H25Br2ClN8O11S3.Na/c1-2-41(17-6-4-3-5-7-17)30-37-28(33)36-29(38-30)35-21-13-18(53(44,45)46)10-15-11-23(55(50,51)52)25(26(42)24(15)21)40-39-20-12-16(34-27(43)19(32)14-31)8-9-22(20)54(47,48)49;/h3-13,19,42H,2,14H2,1H3,(H,34,43)(H,44,45,46)(H,47,48,49)(H,50,51,52)(H,35,36,37,38);/q;+1/p-1
• InChIKey: WITUADBFPJKVKZ-UHFFFAOYSA-M

Properties

• Refractive index: (Cal.)