| SpectraBase Spectrum ID |
IRRTVCvPYZ7 |
| Name |
Methyl 4-[(Z)-(2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]benzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.981102866 u |
| Formula |
C18H12INO4 |
| InChI |
InChI=1S/C18H12INO4/c1-23-17(21)13-4-2-11(3-5-13)10-15-18(22)24-16(20-15)12-6-8-14(19)9-7-12/h2-10H,1H3/b15-10- |
| InChIKey |
DYEZLWCBVMVFMW-GDNBJRDFSA-N |
| Molecular Weight |
433.201 g/mol |
| SMILES |
COC(C=1C=CC(\C=C\2N=C(OC2=O)C2=CC=C(C=C2)I)=CC1)=O |
![methyl 4-[(Z)-(2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]benzoate](/api/spectrum/IRRTVCvPYZ7/structure.png?h=300&w=458 "methyl 4-[(Z)-(2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]benzoate")
