Brilliant Copper Blue BW
[CAS# 6655-96-5]

Identification

• Name: Brilliant Copper Blue BW
• Synonyms: Trisodium (7Z)-7-[[2-Methoxy-4-[3-Methoxy-4-[(N'e)-N'-[1-Oxo-6-(Phenylamino)-3-Sulfonato-2-Naphthylidene]Hydrazino]Phenyl]Phenyl]Hydrazono]-8-Oxo-Naphthalene-1,6-Disulfonate; Trisodium (7Z)-7-[[2-Methoxy-4-[3-Methoxy-4-[(N'e)-N'-[1-Oxo-6-(Phenylamino)-3-Sulfonato-2-Naphthylidene]Hydrazino]Phenyl]Phenyl]Hydrazono]-8-Oxonaphthalene-1,6-Disulfonate; Trisodium (7Z)-8-Keto-7-[[4-[4-[(N'e)-N'-[1-Keto-6-(Phenylamino)-3-Sulfonato-2-Naphthylidene]Hydrazino]-3-Methoxy-Phenyl]-2-Methoxy-Phenyl]Hydrazono]Naphthalene-1,6-Disulfonate
• Molecular Formula: C₄₀H₂₈N₅Na₃O₁₃S₃
• Molecular Weight: 951.84
• CAS Registry Number: 6655-96-5
• EINECS: 229-684-0
• SMILES: C1=CC=C([S]([O-])(=O)=O)C7=C1C=C([S]([O-])(=O)=O)\C(=N/NC6=C(OC)C=C(C5=CC(=C(N\N=C2\C(=CC3=C(C2=O)C=CC(=C3)NC4=CC=CC=C4)[S]([O-])(=O)=O)C=C5)OC)C=C6)C7=O.[Na+].[Na+].[Na+]
• InChI: 1S/C40H31N5O13S3.3Na/c1-57-31-18-22(11-15-29(31)42-44-37-35(61(54,55)56)21-25-17-27(13-14-28(25)39(37)46)41-26-8-4-3-5-9-26)23-12-16-30(32(19-23)58-2)43-45-38-34(60(51,52)53)20-24-7-6-10-33(59(48,49)50)36(24)40(38)47;;;/h3-21,41-43H,1-2H3,(H,48,49,50)(H,51,52,53)(H,54,55,56);;;/q;3*+1/p-3/b44-37-,45-38+
• InChIKey: CECHKUFHGKMSSY-GYSJEACFSA-K