| SpectraBase Spectrum ID |
DcJxsBNvbbo |
| Name |
3-Chloro-2-[(2'-methyl-2,4'-bi(1,3-oxazolyl)-4-ylcarbonylamino]propionic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.046548193 u |
| Formula |
C12H12ClN3O5 |
| InChI |
InChI=1S/C12H12ClN3O5/c1-6-14-9(5-20-6)11-16-8(4-21-11)10(17)15-7(3-13)12(18)19-2/h4-5,7H,3H2,1-2H3,(H,15,17) |
| InChIKey |
QKOOTGZTWCNNIB-UHFFFAOYSA-N |
| Molecular Weight |
313.697 g/mol |
| SMILES |
C=1(N=C(C=2N=C(C)OC2)OC1)C(NC(C(=O)OC)CCl)=O |
![3-Chloro-2-[(2'-methyl-2,4'-bi(1,3-oxazolyl)-4-ylcarbonylamino]propionic acid methyl ester](/api/spectrum/DcJxsBNvbbo/structure.png?h=300&w=458 "3-Chloro-2-[(2'-methyl-2,4'-bi(1,3-oxazolyl)-4-ylcarbonylamino]propionic acid methyl ester")
