| SpectraBase Spectrum ID |
ESENg5aEcIT |
| Name |
1-(p-Phenoxyphenyl)-3-[5'-(4''-nitrophenyl)-1',3',4'-oxadiazol-2'-yl]propan-1-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
415.116820654 u |
| Formula |
C23H17N3O5 |
| InChI |
InChI=1S/C23H17N3O5/c27-21(16-8-12-20(13-9-16)30-19-4-2-1-3-5-19)14-15-22-24-25-23(31-22)17-6-10-18(11-7-17)26(28)29/h1-13H,14-15H2 |
| InChIKey |
KMBFCVKLFRTDSK-UHFFFAOYSA-N |
| Molecular Weight |
415.405 g/mol |
| SMILES |
C1(=NN=C(O1)CCC(C=1C=CC(OC2=CC=CC=C2)=CC1)=O)C=1C=CC(N(=O)=O)=CC1 |