Sodium 4-[(4-Anilino-3-Sulfophenyl)Amino]-3,5-Dinitrobenzoate
[CAS# 6373-76-8]

Identification

• Name: Sodium 4-[(4-Anilino-3-Sulfophenyl)Amino]-3,5-Dinitrobenzoate
• Synonyms: Benzoic acid, 3,5-dinitro-4-[[4-(phenylamino)-3-sulfophenyl]amino]-, monosodium salt
• Molecular Formula: C₁₉H₁₃N₄NaO₉S
• Molecular Weight: 496.38
• CAS Registry Number: 6373-76-8
• SMILES: c1ccc(cc1)Nc2ccc(cc2S(=O)(=O)O)Nc3c(cc(cc3[N+](=O)[O-])C(=O)[O-])[N+](=O)[O-].[Na+]
• InChI: 1S/C19H14N4O9S.Na/c24-19(25)11-8-15(22(26)27)18(16(9-11)23(28)29)21-13-6-7-14(17(10-13)33(30,31)32)20-12-4-2-1-3-5-12;/h1-10,20-21H,(H,24,25)(H,30,31,32);/q;+1/p-1
• InChIKey: DQKWZGAUMHSKOC-UHFFFAOYSA-M