Methyl (2S)-2-[[2-(2-Nitroimidazol-1-Yl)Acetyl]Amino]-3-Phenylpropanoate
[CAS# 140448-29-9]

Identification

• Name: Methyl (2S)-2-[[2-(2-Nitroimidazol-1-Yl)Acetyl]Amino]-3-Phenylpropanoate
• Synonyms: Methyl (2S)-2-[[2-(2-Nitroimidazol-1-Yl)Acetyl]Amino]-3-Phenyl-Propanoate; (2S)-2-[[2-(2-Nitro-1-Imidazolyl)-1-Oxoethyl]Amino]-3-Phenylpropanoic Acid Methyl Ester; (2S)-2-[[2-(2-Nitroimidazol-1-Yl)Acetyl]Amino]-3-Phenyl-Propionic Acid Methyl Ester
• Molecular Formula: C₁₅H₁₆N₄O₅
• Molecular Weight: 332.32
• CAS Registry Number: 140448-29-9
• SMILES: [C@@H](NC(=O)C[N]1C(=NC=C1)[N+]([O-])=O)(C(OC)=O)CC2=CC=CC=C2
• InChI: 1S/C15H16N4O5/c1-24-14(21)12(9-11-5-3-2-4-6-11)17-13(20)10-18-8-7-16-15(18)19(22)23/h2-8,12H,9-10H2,1H3,(H,17,20)/t12-/m0/s1
• InChIKey: VQNUUFHSMPUSHU-LBPRGKRZSA-N

Properties

• Density: 1.369g/cm³ (Cal.)