SpectraBase Spectrum ID |
2kTDyS84lG4 |
Name |
Benazepril |
CAS Registry Number |
86541-75-5 |
Classification |
Pharmaceutical drug, ACE inhibitor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
424.199822005 u |
Formula |
C24H28N2O5 |
InChI |
InChI=1S/C24H28N2O5/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/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28)/t19-,20?/m0/s1 |
InChIKey |
XPCFTKFZXHTYIP-XJDOXCRVSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
424.497 g/mol |
Nominal Mass |
424 u |
Quality |
940 |
SMILES |
OC(CN1C=2C(CC[C@@](C1=O)(NC(C(OCC)=O)CCC=1C=CC=CC1)[H])=CC=CC2)=O |
SPLASH |
splash10-0udl-2914000000-0d0e6163bc12a7eae3b2 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Acetic acid,2-[(4s)-4-[[(1S)-1-Ethoxycarbonyl-3-phenyl-propyl]amino]-5-oxo-6-azabicyclo[5.4.0]-\rundeca-7,9,11-trien-6-yl]
2-[(4S)-4-[[(1S)-1-Ethoxycarbonyl-3-phenyl-propyl]amino]-5-oxo-6-azabicyclo[5.4.0]-\rundeca-7,9,11-trien-6-yl]acetic acid |
Technique |
DI/MS |
Wiley ID |
DD2024_006339 |