Quinaprilat
[CAS# 85441-60-7]

Identification

• Name: Quinaprilat
• Synonyms: (3S)-2-[(2S)-2-[[(1S)-1-Carboxy-3-Phenyl-Propyl]Amino]Propanoyl]-3,4-Dihydro-1H-Isoquinoline-3-Carboxylic Acid; (3S)-2-[(2S)-2-[[(1S)-1-Carboxy-3-Phenylpropyl]Amino]-1-Oxopropyl]-3,4-Dihydro-1H-Isoquinoline-3-Carboxylic Acid; (3S)-2-[(2S)-2-[[(2S)-1-Hydroxy-1-Oxo-4-Phenyl-Butan-2-Yl]Amino]Propanoyl]-3,4-Dihydro-1H-Isoquinoline-3-Carboxylic Acid
• Molecular Formula: C₂₃H₂₆N₂O₅
• Molecular Weight: 410.47
• CAS Registry Number: 85441-60-7
• SMILES: [C@@H]1(N(CC2=C(C1)C=CC=C2)C([C@@H](N[C@@H](CCC3=CC=CC=C3)C(O)=O)C)=O)C(O)=O
• InChI: 1S/C23H26N2O5/c1-15(24-19(22(27)28)12-11-16-7-3-2-4-8-16)21(26)25-14-18-10-6-5-9-17(18)13-20(25)23(29)30/h2-10,15,19-20,24H,11-14H2,1H3,(H,27,28)(H,29,30)/t15-,19-,20-/m0/s1
• InChIKey: FLSLEGPOVLMJMN-YSSFQJQWSA-N

Properties

• Density: 1.29g/cm³ (Cal.)
• Boiling point: 674.537°C at 760 mmHg (Cal.)
• Flash point: 361.747°C (Cal.)