SpectraBase Spectrum ID |
1w71XN3O2i |
Name |
Diethyl 1-[(2S-carbamoyl-3-phenyl)-propyl]-1H-[1,2,3]triazole-4,5-dicarboxylate |
Alternate Name(s) |
Diethyl 1-[(2S)-3-amino-2-benzyl-3-oxopropyl]-1H-1,2,3-triazole-4,5-dicarboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H22N4O5 |
InChI |
InChI=1S/C18H22N4O5/c1-3-26-17(24)14-15(18(25)27-4-2)22(21-20-14)11-13(16(19)23)10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H2,19,23)/t13-/m0/s1 |
InChIKey |
OBXAJYXJTAGQOL-ZDUSSCGKSA-N |
Molecular Weight |
374.397 g/mol |
SMILES |
NC([C@](C[n]1c(c(nn1)C(=O)OCC)C(=O)OCC)(Cc1ccccc1)[H])=O |
SPLASH |
splash10-02tc-1900000000-d03c77d5c20b9e91e215 |
Source of Spectrum |
QC-17-2375-14 |
Wiley ID |
1638462 |