| SpectraBase Spectrum ID |
8JjNbWJQ4rE |
| Name |
7-{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
493.087447820 u |
| Formula |
C22H21ClFN3O5S |
| InChI |
InChI=1S/C22H21ClFN3O5S/c1-2-25-13-17(22(29)30)21(28)16-11-18(24)20(12-19(16)25)26-7-9-27(10-8-26)33(31,32)15-5-3-14(23)4-6-15/h3-6,11-13H,2,7-10H2,1H3,(H,29,30) |
| InChIKey |
LLGYTLXTKQDECH-UHFFFAOYSA-N |
| Molecular Weight |
493.937 g/mol |
| SMILES |
OC(C=1C(C2=CC(F)=C(C=C2N(C1)CC)N1CCN(S(C2=CC=C(C=C2)Cl)(=O)=O)CC1)=O)=O |
![7-{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid](/api/spectrum/8JjNbWJQ4rE/structure.png?h=300&w=458 "7-{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid")
