Sodium 3-[[(4E)-4-[(5-Nitropyridin-2-Yl)Hydrazinylidene]-3-Oxo-1-Cyclohexa-1,5-Dienyl]-Propylamino]Propane-1-Sulfonate
[CAS# 113516-70-4]

Identification

• Name: Sodium 3-[[(4E)-4-[(5-Nitropyridin-2-Yl)Hydrazinylidene]-3-Oxo-1-Cyclohexa-1,5-Dienyl]-Propylamino]Propane-1-Sulfonate
• Synonyms: Sodium 3-[[(4E)-4-[(5-Nitro-2-Pyridyl)Hydrazono]-3-Oxo-1-Cyclohexa-1,5-Dienyl]-Propyl-Amino]Propane-1-Sulfonate; Sodium 3-[[(4E)-4-[(5-Nitro-2-Pyridyl)Hydrazono]-3-Oxo-1-Cyclohexa-1,5-Dienyl]-Propylamino]Propane-1-Sulfonate; Sodium 3-[[(4E)-3-Keto-4-[(5-Nitro-2-Pyridyl)Hydrazono]-1-Cyclohexa-1,5-Dienyl]-Propyl-Amino]Propane-1-Sulfonate
• Molecular Formula: C₁₇H₂₀N₅NaO₆S
• Molecular Weight: 445.42
• CAS Registry Number: 113516-70-4
• SMILES: C1=CC(=CN=C1N\N=C2\C(=O)C=C(N(CCC[S]([O-])(=O)=O)CCC)C=C2)[N+]([O-])=O.[Na+]
• InChI: 1S/C17H21N5O6S.Na/c1-2-8-21(9-3-10-29(26,27)28)13-4-6-15(16(23)11-13)19-20-17-7-5-14(12-18-17)22(24)25;/h4-7,11-12H,2-3,8-10H2,1H3,(H,18,20)(H,26,27,28);/q;+1/p-1/b19-15+
• InChIKey: JPVHXZKFXXYXLI-QTCZRQAZSA-M