Trisodium 4-Hydroxy-7-[({5-Hydroxy-6-[(2-Methylphenyl)Diazenyl]-7-Sulfonato-2-Naphthyl}Carbamoyl)Amino]-3-[(4-Sulfonatophenyl)Diazenyl]-2-Naphthalenesulfonate
[CAS# 6358-79-8]

Identification

• Name: Trisodium 4-Hydroxy-7-[({5-Hydroxy-6-[(2-Methylphenyl)Diazenyl]-7-Sulfonato-2-Naphthyl}Carbamoyl)Amino]-3-[(4-Sulfonatophenyl)Diazenyl]-2-Naphthalenesulfonate
• Synonyms: 2-Naphthalenesulfonic acid, 4-hydroxy-7-[[[[5-hydroxy-6-[(2-methylphenyl)azo]-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-3-[(4-sulfophenyl)azo]-, trisodium salt
• Molecular Formula: C₃₄H₂₃N₆Na₃O₁₂S₃
• Molecular Weight: 872.74
• CAS Registry Number: 6358-79-8
• SMILES: Cc1ccccc1N=Nc2c(cc3cc(ccc3c2O)NC(=O)Nc4ccc5c(c4)cc(c(c5O)N=Nc6ccc(cc6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
• InChI: 1S/C34H26N6O12S3.3Na/c1-18-4-2-3-5-27(18)38-40-31-29(55(50,51)52)17-20-15-23(9-13-26(20)33(31)42)36-34(43)35-22-8-12-25-19(14-22)16-28(54(47,48)49)30(32(25)41)39-37-21-6-10-24(11-7-21)53(44,45)46;;;/h2-17,41-42H,1H3,(H2,35,36,43)(H,44,45,46)(H,47,48,49)(H,50,51,52);;;/q;3*+1/p-3
• InChIKey: YYRCBWUIMOBUCH-UHFFFAOYSA-K