SpectraBase Spectrum ID |
8QeiNXKhoyK |
Name |
Ethyl 4-[4-(acetyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
399.168187523 u |
Formula |
C22H25NO6 |
InChI |
InChI=1S/C22H25NO6/c1-5-28-22(26)19-12(2)23-15-7-6-8-16(25)21(15)20(19)14-9-10-17(29-13(3)24)18(11-14)27-4/h9-11,20,23H,5-8H2,1-4H3 |
InChIKey |
DRRWQWXLYUIXDC-UHFFFAOYSA-N |
Molecular Weight |
399.443 g/mol |
SMILES |
N1C(=C(C(C=2C(CCCC12)=O)C=1C=C(OC)C(=CC1)OC(=O)C)C(=O)OCC)C |