[(3S)-3-[[(1S)-3-cyclohexyl-1-(ethoxycarbonyl)propyl]amino]-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H34N2O5
Molecular Weight	430.5372
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of [(3S)-3-[[(1S)-3-cyclohexyl-1-(ethoxycarbonyl)propyl]amino]-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid

Structure Search

SMILES

CCOC(=O)[C@H](CCC1CCCCC1)N[C@H]2CCC3=CC=CC=C3N(CC(O)=O)C2=O

InChI

InChIKey=QIUMIMWTDKEVBO-PMACEKPBSA-N

InChI=1S/C24H34N2O5/c1-2-31-24(30)20(14-12-17-8-4-3-5-9-17)25-19-15-13-18-10-6-7-11-21(18)26(23(19)29)16-22(27)28/h6-7,10-11,17,19-20,25H,2-5,8-9,12-16H2,1H3,(H,27,28)/t19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H34N2O5
Molecular Weight	430.5372
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:39:25 GMT 2025` Edited by `admin` on `Mon Mar 31 21:39:25 GMT 2025`
Record UNII	9R78150JQU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-1-Benzazepine-1-acetic acid, 3-[[3-cyclohexyl-1-(ethoxycarbonyl)propyl]amino]-2,3,4,5-tetrahydro-2-oxo-, [S-(R*,R*)]-

Preferred Name

English

[(3S)-3-[[(1S)-3-cyclohexyl-1-(ethoxycarbonyl)propyl]amino]-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid

Systematic Name

English

BENAZEPRIL HYDROCHLORIDE IMPURITY D [EP IMPURITY]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID80149921

Created by admin on Mon Mar 31 21:39:25 GMT 2025 , Edited by admin on Mon Mar 31 21:39:25 GMT 2025

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CAS

112110-48-2

Created by admin on Mon Mar 31 21:39:25 GMT 2025 , Edited by admin on Mon Mar 31 21:39:25 GMT 2025

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FDA UNII

9R78150JQU

Created by admin on Mon Mar 31 21:39:25 GMT 2025 , Edited by admin on Mon Mar 31 21:39:25 GMT 2025

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PUBCHEM

71587421

Created by admin on Mon Mar 31 21:39:25 GMT 2025 , Edited by admin on Mon Mar 31 21:39:25 GMT 2025

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Related Record Type Details


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BENAZEPRIL HYDROCHLORIDE

PARENT -> IMPURITY

Comments:

Impurity D: not more than the area of the principal peak in the chromatogram obtained with reference solution (c) (0.2 per cent)

Amount: