SpectraBase Spectrum ID |
A2NMpnTjFNq |
Name |
Ethyl N-acetyl-N-[5'-(4""-chlorobenzylidene)-4'-oxo-2'-imidazolinyl]-glycinate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
349.082933703 u |
Formula |
C16H16ClN3O4 |
InChI |
InChI=1S/C16H16ClN3O4/c1-3-24-14(22)9-20(10(2)21)16-18-13(15(23)19-16)8-11-4-6-12(17)7-5-11/h4-8H,3,9H2,1-2H3,(H,18,19,23)/b13-8+ |
InChIKey |
FIGBOKRDHXJLGI-MDWZMJQESA-N |
Molecular Weight |
349.774 g/mol |
SMILES |
C=1(NC(=O)\C(N1)=C/C1=CC=C(C=C1)Cl)N(C(=O)C)CC(=O)OCC |