Trisodium 8-[[4-Methyl-3-[(3-Nitrobenzoyl)Amino]Benzoyl]Amino]Naphthalene-1,3,5-Trisulphonate
[CAS# 81207-64-9]

Identification

• Name: Trisodium 8-[[4-Methyl-3-[(3-Nitrobenzoyl)Amino]Benzoyl]Amino]Naphthalene-1,3,5-Trisulphonate
• Synonyms: Trisodium 8-[[[4-Methyl-3-[[(3-Nitrophenyl)-Oxomethyl]Amino]Phenyl]-Oxomethyl]Amino]Naphthalene-1,3,5-Trisulfonate; Trisodium 8-[[4-Methyl-3-[(3-Nitrophenyl)Carbonylamino]Phenyl]Carbonylamino]Naphthalene-1,3,5-Trisulfonate
• Molecular Formula: C₂₅H₁₆N₃Na₃O₁₃S₃
• Molecular Weight: 731.56
• CAS Registry Number: 81207-64-9
• EINECS: 279-705-2
• SMILES: C1=C([S]([O-])(=O)=O)C=C([S]([O-])(=O)=O)C2=C1C(=CC=C2NC(=O)C3=CC(=C(C=C3)C)NC(=O)C4=CC(=CC=C4)[N+]([O-])=O)[S]([O-])(=O)=O.[Na+].[Na+].[Na+]
• InChI: 1S/C25H19N3O13S3.3Na/c1-13-5-6-15(10-20(13)27-24(29)14-3-2-4-16(9-14)28(31)32)25(30)26-19-7-8-21(43(36,37)38)18-11-17(42(33,34)35)12-22(23(18)19)44(39,40)41;;;/h2-12H,1H3,(H,26,30)(H,27,29)(H,33,34,35)(H,36,37,38)(H,39,40,41);;;/q;3*+1/p-3
• InChIKey: FQTYEEMSPBWVLV-UHFFFAOYSA-K