| SpectraBase Spectrum ID |
ETRtsjUpvrL |
| Name |
Benzoic acid, 4-[1-(4-fluorophenyl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-B]pyridin-4-yl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
365.117569547 u |
| Formula |
C20H16FN3O3 |
| InChI |
InChI=1S/C20H16FN3O3/c1-11-18-16(12-2-4-13(5-3-12)20(26)27)10-17(25)22-19(18)24(23-11)15-8-6-14(21)7-9-15/h2-9,16H,10H2,1H3,(H,22,25)(H,26,27) |
| InChIKey |
KEESLEQZVSHAKX-UHFFFAOYSA-N |
| Molecular Weight |
365.364 g/mol |
| SMILES |
OC(C1=CC=C(C2C3=C(N(N=C3C)C=3C=CC(=CC3)F)NC(C2)=O)C=C1)=O |
![benzoic acid, 4-[1-(4-fluorophenyl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-b]pyridin-4-yl]-](/api/spectrum/ETRtsjUpvrL/structure.png?h=300&w=458 "benzoic acid, 4-[1-(4-fluorophenyl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-b]pyridin-4-yl]-")
