![1,4-Dimethyl N-[(2E)-3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl]-L-aspartate](https://resource.bocsci.com/structure/1357599-84-8.gif)
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| IUPAC Name: | dimethyl (2S)-2-[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]amino]butanedioate |
| Description: | 1,4-Dimethyl N-[(2E)-3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl]-L-aspartate is an intermediate in the synthesis of N-[(2E)-3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl]-L-aspartic Acid (D790020), used to treat or prevent receptor tyrosine kinases related disorders. |
| Molecular Weight: | 323.3 |
| Molecular Formula: | C15H17NO7 |
| Canonical SMILES: | COC(=O)CC(C(=O)OC)NC(=O)C=CC1=CC(=C(C=C1)O)O |
| InChI: | InChI=1S/C15H17NO7/c1-22-14(20)8-10(15(21)23-2)16-13(19)6-4-9-3-5-11(17)12(18)7-9/h3-7,10,17-18H,8H2,1-2H3,(H,16,19)/b6-4+/t10-/m0/s1 |
| InChI Key: | BCZOZPJEPHTSJK-RWCYGVJQSA-N |
| References: | Legeai-Mallet, L., et.al., PCT Int. Appl., 49, (2016). |
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