Methyl N-(Butoxycarbonyl)-3-({[(5R)-3-(4-Cyanophenyl)-4,5-Dihydro-1,2-Oxazol-5-Yl]Acetyl}Amino)-L-Alaninate
[CAS# 188016-51-5]

Identification

• Name: Methyl N-(Butoxycarbonyl)-3-({[(5R)-3-(4-Cyanophenyl)-4,5-Dihydro-1,2-Oxazol-5-Yl]Acetyl}Amino)-L-Alaninate
• Molecular Formula: C₂₁H₂₆N₄O₆
• Molecular Weight: 430.45
• CAS Registry Number: 188016-51-5
• SMILES: O=C(OC)[C@@H](NC(=O)OCCCC)CNC(=O)C[C@@H]2O\N=C(\c1ccc(C#N)cc1)C2
• InChI: 1S/C21H26N4O6/c1-3-4-9-30-21(28)24-18(20(27)29-2)13-23-19(26)11-16-10-17(25-31-16)15-7-5-14(12-22)6-8-15/h5-8,16,18H,3-4,9-11,13H2,1-2H3,(H,23,26)(H,24,28)/t16-,18+/m1/s1
• InChIKey: FTQRLUOLHGFRQY-AEFFLSMTSA-N

Properties

• Density: 1.289g/cm³ (Cal.)
• Refractive index: 1.584 (Cal.)