N-[(2E,3E)-2-(Ethoxyimino)-5-Nitro-3-Hexen-1-Yl]Nicotinamide
[CAS# 162626-99-5]

Identification

• Classification: Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyridine compound >> Ethylpyridine
• Name: N-[(2E,3E)-2-(Ethoxyimino)-5-Nitro-3-Hexen-1-Yl]Nicotinamide
• Synonyms: 3-Pyridinecarboxamide, N-[(2E,3E)-2-(ethoxyimino)-5-nitro-3-hexen-1-yl]-; N-[(2E,3E)-2-(Ethoxyimino)-5-nitro-3-hexen-1-yl]nicotinamid; N-[(2E,3E)-2-(Ethoxyimino)-5-nitro-3-hexen-1-yl]nicotinamide
• Molecular Formula: C₁₄H₁₈N₄O₄
• Molecular Weight: 306.32
• CAS Registry Number: 162626-99-5
• SMILES: CCO/N=C(/CNC(=O)c1cccnc1)\C=C\C(C)[N+](=O)[O-]
• InChI: 1S/C14H18N4O4/c1-3-22-17-13(7-6-11(2)18(20)21)10-16-14(19)12-5-4-8-15-9-12/h4-9,11H,3,10H2,1-2H3,(H,16,19)/b7-6+,17-13+
• InChIKey: BSMGQVOYPQZEOC-LZCBAFEFSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Refractive index: 1.56 (Cal.)