| SpectraBase Spectrum ID |
Ei5Fdqhtgsc |
| Name |
1-(3,5-Dimethyl-phenyl)-4-(2-methyl-5-nitro-benzenesulfonyl)-piperazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.140927403 u |
| Formula |
C19H23N3O4S |
| InChI |
InChI=1S/C19H23N3O4S/c1-14-10-15(2)12-18(11-14)20-6-8-21(9-7-20)27(25,26)19-13-17(22(23)24)5-4-16(19)3/h4-5,10-13H,6-9H2,1-3H3 |
| InChIKey |
UZWHYWSGCSYVQX-UHFFFAOYSA-N |
| Molecular Weight |
389.470 g/mol |
| SMILES |
CC=1C=C(N2CCN(S(C3=CC(N(=O)=O)=CC=C3C)(=O)=O)CC2)C=C(C1)C |
