Indolapril structure

Indolapril

(2S,3aS,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

Also Known As: Indolapril|Indolaprilum|Indolapril [INN]|Indolaprilum [Latin]|Sch 31846|Sch-31846|PD-109,763-2|(2S,3aS,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid|1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-2,|(2S,3aS,7aS)-1-((S)-N-((S)-1-Carboxy-3-phenylpropyl)alanyl)hexahydro-2-indolinecarobxylic acid 1-ethyl ester|(2S,3aS,7aS)-1-(N-((S)-1-Ethoxycarbonyl-3-phenylpropyl)-L-alanyl)-2-hexahydroindolinecarbonsaeure|1-(N-(1-(ethoxycarbonyl)-3-phenylpropyl)alanyl)octahydro-1H-indole-2-carboxylic acid|(2S,3abeta,7abeta)-1-[(2S)-2-[[(1S)-1-[Ethoxycarbonyl]-3-phenylpropyl]amino]-1-oxopropyl]octahydro-1H-indole-2-carboxylic acid|(2S,3abeta,7abeta)-1-[(S)-2-[[(S)-1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]octahydro-1H-indole-2-carboxylic acid|(2S,3AS,7AS)-1-((S)-N-((S)-1-CARBOXY-3-PHENYLPROPYL)ALANYL)HEXAHYDRO-2-INDOLINECARBOXYLIC ACID, 1-ETHYL ESTER|(2S,3aS,7aS)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]-octahydro-1H-indole-2-carboxylic acid|1H-INDOLE-2-CARBOXYLIC ACID, 1-((2S)-2-(((1S)-1-(ETHOXYCARBONYL)-3-PHENYLPROPYL)AMINO)-1-OXOPROPYL)OCTAHYDRO-, (2S,3AS,7AS)-|1H-INDOLE-2-CARBOXYLIC ACID, 1-(2-((1-(ETHOXYCARBONYL)-3-PHENYLPROPYL)AMINO)-1-OXOPROPYL)OCTAHYDRO-, (2S-(1(R*(R*)),2.ALPHA.,3A.BETA.,7A.BETA.))-|1H-Indole-2-carboxylic acid, octahydro-1-(2-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)-, (2S-(1(R*(R*)),2-alpha,3a-beta,7a-beta))-

CAS: 80876-01-3
Molecular Formula C24H34N2O5
Molecular Weight 430.24677 g/mol
LogP 2.7733
Topological Polar Surface Area 95.94 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 9
Exact Mass 430.24677
Monoisotopic Mass 430.24677
Heavy Atoms 31
Complexity 768.493

Chemical Identifiers

CAS Number 80876-01-3
SMILES CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2[C@H]3CCCC[C@H]3C[C@H]2C(=O)O

Product Overview

Indolapril (CAS 80876-01-3), with molecular formula C24H34N2O5 and molecular weight 430.24677 g/mol. IUPAC: (2S,3aS,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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