| SpectraBase Spectrum ID |
Es5OfZ75PNQ |
| Name |
1-{[3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-4-(4-methoxyphenyl)piperazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.125547408 u |
| Formula |
C22H21ClFN3O3 |
| InChI |
InChI=1S/C22H21ClFN3O3/c1-14-19(21(25-30-14)20-17(23)4-3-5-18(20)24)22(28)27-12-10-26(11-13-27)15-6-8-16(29-2)9-7-15/h3-9H,10-13H2,1-2H3 |
| InChIKey |
ZMWFQCBVBWXBSU-UHFFFAOYSA-N |
| Molecular Weight |
429.879 g/mol |
| SMILES |
C=1(C(=NOC1C)C=1C(F)=CC=CC1Cl)C(N1CCN(CC1)C1=CC=C(C=C1)OC)=O |
![1-{[3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-4-(4-methoxyphenyl)piperazine](/api/spectrum/Es5OfZ75PNQ/structure.png?h=300&w=458 "1-{[3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-4-(4-methoxyphenyl)piperazine")
