3-Nitro-4-[2-[2-Oxo-1-[(Phenylamino)Carbonyl]Propyl]Diazenyl]-Benzenesulfonic Acid Sodium Salt(1:1)
[CAS# 68834-04-8]

Identification

• Name: 3-Nitro-4-[2-[2-Oxo-1-[(Phenylamino)Carbonyl]Propyl]Diazenyl]-Benzenesulfonic Acid Sodium Salt(1:1)
• Synonyms: Sodium 3-Nitro-4-[2-Oxo-1-(Phenylcarbamoyl)Propyl]Azo-Benzenesulfonate; Sodium 3-Nitro-4-[2-Oxo-1-[Oxo-(Phenylamino)Methyl]Propyl]Azobenzenesulfonate; Sodium 4-[2-Keto-1-(Phenylcarbamoyl)Propyl]Azo-3-Nitro-Benzenesulfonate
• Molecular Formula: C₁₆H₁₃N₄NaO₇S
• Molecular Weight: 428.35
• CAS Registry Number: 68834-04-8
• EINECS: 272-430-9
• SMILES: C1=C([N+]([O-])=O)C(=CC=C1[S]([O-])(=O)=O)N=NC(C(=O)NC2=CC=CC=C2)C(=O)C.[Na+]
• InChI: 1S/C16H14N4O7S.Na/c1-10(21)15(16(22)17-11-5-3-2-4-6-11)19-18-13-8-7-12(28(25,26)27)9-14(13)20(23)24;/h2-9,15H,1H3,(H,17,22)(H,25,26,27);/q;+1/p-1
• InChIKey: RBRLUNJQBQJIDD-UHFFFAOYSA-M