| SpectraBase Spectrum ID |
EA3UlwLof41 |
| Name |
Methyl 2-(N-Acetylamino)-3-(3,5-dibromo4-oxo-1-hydroxyphenyl)propanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13Br2NO5 |
| InChI |
InChI=1S/C12H13Br2NO5/c1-6(16)15-9(11(18)20-2)5-12(19)3-7(13)10(17)8(14)4-12/h3-4,9,19H,5H2,1-2H3,(H,15,16)/t9-/m0/s1 |
| InChIKey |
LEEKEHLOJLYQBD-VIFPVBQESA-N |
| Molecular Weight |
411.046 g/mol |
| SMILES |
N([C@@](CC1(C=C(C(C(=C1)Br)=O)Br)O)(C(=O)OC)[H])C(=O)C |
| SPLASH |
splash10-0006-9052000000-71d9bf01c953c7679ce5 |
| Source of Spectrum |
KC-0-3119-7 |
| Synonyms |
Methyl (S)2-(N-Acetylamino)-3-(3,5-dibromo4-oxo-1-hydroxyphenyl)propanoate
Methyl 2-(acetylamino)-3-(3,5-dibromo-1-hydroxy-4-oxo-2,5-cyclohexadien-1-yl)propanoate
(2S)-2-acetamido-3-(3,5-dibromo-1-hydroxy-4-oxo-1-cyclohexa-2,5-dienyl)propanoic acid methyl ester
Methyl (2S)-2-acetamido-3-(3,5-dibromo-1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)propanoate
Methyl (2S)-2-acetamido-3-(3,5-dibromo-1-hydroxy-4-oxo-cyclohexa-2,5-dien-1-yl)propanoate
Methyl (2S)-2-acetamido-3-[3,5-bis(bromanyl)-1-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl]propanoate |
| Wiley ID |
780326 |
