Trandolaprilat
[CAS# 83601-86-9]

Identification

• Name: Trandolaprilat
• Synonyms: 1-[2-[(1-Carboxy-3-Phenyl-Propyl)Amino]Propanoyl]-2,3,3A,4,5,6,7,7A-Octahydroindole-2-Carboxylic Acid; 1-[2-[(1-Carboxy-3-Phenylpropyl)Amino]-1-Oxopropyl]-2,3,3A,4,5,6,7,7A-Octahydroindole-2-Carboxylic Acid; 1-[2-[(1-Hydroxy-1-Oxo-4-Phenyl-Butan-2-Yl)Amino]Propanoyl]-2,3,3A,4,5,6,7,7A-Octahydroindole-2-Carboxylic Acid
• Molecular Formula: C₂₂H₃₀N₂O₅
• Molecular Weight: 402.49
• CAS Registry Number: 83601-86-9
• SMILES: C1=CC=CC=C1CCC(NC(C(N3C2C(CCCC2)CC3C(O)=O)=O)C)C(O)=O
• InChI: 1S/C22H30N2O5/c1-14(23-17(21(26)27)12-11-15-7-3-2-4-8-15)20(25)24-18-10-6-5-9-16(18)13-19(24)22(28)29/h2-4,7-8,14,16-19,23H,5-6,9-13H2,1H3,(H,26,27)(H,28,29)
• InChIKey: AHYHTSYNOHNUSH-UHFFFAOYSA-N

Properties

• Density: 1.247g/cm³ (Cal.)
• Boiling point: 640.541°C at 760 mmHg (Cal.)
• Flash point: 341.187°C (Cal.)