Tetrasodium 4-[[1-Hydroxy-6-[[[[5-Hydroxy-6-[(2-Methyl-4-Sulphonatophenyl)Azo]-7-Sulphonato-2-Naphthyl]Amino]Carbonyl]Amino]-3-Sulphonato-2-Naphthyl]Azo]Benzoate
[CAS# 65072-27-7]

Identification

• Name: Tetrasodium 4-[[1-Hydroxy-6-[[[[5-Hydroxy-6-[(2-Methyl-4-Sulphonatophenyl)Azo]-7-Sulphonato-2-Naphthyl]Amino]Carbonyl]Amino]-3-Sulphonato-2-Naphthyl]Azo]Benzoate
• Synonyms: Tetrasodium 4-[(N'e)-N'-[6-[[(6Z)-6-[(2-Methyl-4-Sulfonato-Phenyl)Hydrazono]-5-Oxo-7-Sulfonato-2-Naphthyl]Carbamoylamino]-1-Oxo-3-Sulfonato-2-Naphthylidene]Hydrazino]Benzoate; Tetrasodium 4-[(N'e)-N'-[6-[[[[(6Z)-6-[(2-Methyl-4-Sulfonatophenyl)Hydrazono]-5-Oxo-7-Sulfonato-2-Naphthyl]Amino]-Oxomethyl]Amino]-1-Oxo-3-Sulfonato-2-Naphthylidene]Hydrazino]Benzoate; Tetrasodium 4-[(N'e)-N'-[1-Keto-6-[[(6Z)-5-Keto-6-[(2-Methyl-4-Sulfonato-Phenyl)Hydrazono]-7-Sulfonato-2-Naphthyl]Carbamoylamino]-3-Sulfonato-2-Naphthylidene]Hydrazino]Benzoate
• Molecular Formula: C₃₅H₂₂N₆Na₄O₁₄S₃
• Molecular Weight: 938.73
• CAS Registry Number: 65072-27-7
• EINECS: 265-365-2
• SMILES: C4=C(NC(=O)NC3=CC2=C(C(=O)C(=N/NC1=CC=C(C=C1)C([O-])=O)\C(=C2)[S]([O-])(=O)=O)C=C3)C=CC6=C4C=C([S]([O-])(=O)=O)\C(=N/NC5=C(C=C([S]([O-])(=O)=O)C=C5)C)C6=O.[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C35H26N6O14S3.4Na/c1-17-12-24(56(47,48)49)8-11-27(17)39-41-31-29(58(53,54)55)16-20-14-23(7-10-26(20)33(31)43)37-35(46)36-22-6-9-25-19(13-22)15-28(57(50,51)52)30(32(25)42)40-38-21-4-2-18(3-5-21)34(44)45;;;;/h2-16,38-39H,1H3,(H,44,45)(H2,36,37,46)(H,47,48,49)(H,50,51,52)(H,53,54,55);;;;/q;4*+1/p-4/b40-30-,41-31+
• InChIKey: NHIDVVWMCAHSQR-VZDIWHCLSA-J