Trisodium 8-[(4-Methyl-3-Nitrobenzoyl)Amino]Naphthalene-1,3,5-Trisulphonate
[CAS# 69031-54-5]

Identification

• Name: Trisodium 8-[(4-Methyl-3-Nitrobenzoyl)Amino]Naphthalene-1,3,5-Trisulphonate
• Synonyms: Trisodium 8-[(4-Methyl-3-Nitro-Benzoyl)Amino]Naphthalene-1,3,5-Trisulfonate; Trisodium 8-[[(4-Methyl-3-Nitrophenyl)-Oxomethyl]Amino]Naphthalene-1,3,5-Trisulfonate; Trisodium 8-[(4-Methyl-3-Nitro-Phenyl)Carbonylamino]Naphthalene-1,3,5-Trisulfonate
• Molecular Formula: C₁₈H₁₁N₂Na₃O₁₂S₃
• Molecular Weight: 612.44
• CAS Registry Number: 69031-54-5
• EINECS: 273-840-0
• SMILES: C1=C([S]([O-])(=O)=O)C=C([S]([O-])(=O)=O)C2=C1C(=CC=C2NC(=O)C3=CC(=C(C=C3)C)[N+]([O-])=O)[S]([O-])(=O)=O.[Na+].[Na+].[Na+]
• InChI: 1S/C18H14N2O12S3.3Na/c1-9-2-3-10(6-14(9)20(22)23)18(21)19-13-4-5-15(34(27,28)29)12-7-11(33(24,25)26)8-16(17(12)13)35(30,31)32;;;/h2-8H,1H3,(H,19,21)(H,24,25,26)(H,27,28,29)(H,30,31,32);;;/q;3*+1/p-3
• InChIKey: YCCFZXJJUOXAGV-UHFFFAOYSA-K