| SpectraBase Spectrum ID |
IGmu7PsByE5 |
| Name |
2-[2,5-Diketo-4-(4-methoxyphenyl)-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzoic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.141972775 u |
| Formula |
C23H21NO5 |
| InChI |
InChI=1S/C23H21NO5/c1-29-15-11-9-14(10-12-15)17-13-21(26)24(19-7-4-8-20(25)22(17)19)18-6-3-2-5-16(18)23(27)28/h2-3,5-6,9-12,17H,4,7-8,13H2,1H3,(H,27,28) |
| InChIKey |
XWKXEIDUOWTIQW-UHFFFAOYSA-N |
| Molecular Weight |
391.423 g/mol |
| SMILES |
C1=2N(C(CC(C2C(CCC1)=O)C=1C=CC(=CC1)OC)=O)C=1C(=CC=CC1)C(O)=O |
![2-[2,5-diketo-4-(4-methoxyphenyl)-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzoic acid](/api/spectrum/IGmu7PsByE5/structure.png?h=300&w=458 "2-[2,5-diketo-4-(4-methoxyphenyl)-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzoic acid")
