| SpectraBase Spectrum ID |
BhTt3s3iLtG |
| Name |
Isopropyl 3-(4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)-2-methyl-2-nitropropanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24N4O4S |
| InChI |
InChI=1S/C18H24N4O4S/c1-13(2)26-17(23)18(3,22(24)25)12-20-8-10-21(11-9-20)16-14-6-4-5-7-15(14)27-19-16/h4-7,13H,8-12H2,1-3H3 |
| InChIKey |
NREANKCLHTWRCY-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/asia.201300053 |
| Molecular Weight |
392.474 g/mol |
| SMILES |
C(N1CCN(c2c3c(sn2)cccc3)CC1)C(C(OC(C)C)=O)([N+](=O)[O-])C |
| SPLASH |
splash10-02tc-4890000000-bf551c0afa04a6ff3953 |
| Source of Spectrum |
CAJ-8-877/SM10-6c |
| Wiley ID |
1771982 |
![Isopropyl 3-(4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)-2-methyl-2-nitropropanoate](/api/spectrum/BhTt3s3iLtG/structure.png?h=300&w=458 "Isopropyl 3-(4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)-2-methyl-2-nitropropanoate")
