| SpectraBase Spectrum ID |
IoMyM2ZFZLx |
| Name |
3,4-Pyrrolidinedicarboxylic acid, 1-acetyl-2-cyano-5-(2-hydroxyphenyl)-, dimethyl ester |
| CAS Registry Number |
122373-09-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18N2O6 |
| InChI |
InChI=1S/C17H18N2O6/c1-9(20)19-11(8-18)13(16(22)24-2)14(17(23)25-3)15(19)10-6-4-5-7-12(10)21/h4-7,11,13-15,21H,1-3H3/t11?,13?,14-,15+/m0/s1 |
| InChIKey |
NEPQGKYYOOAUSU-RIXNLZLZSA-N |
| Molecular Weight |
346.339 g/mol |
| SMILES |
Oc1c([C@@]2([C@@](C(=O)OC)(C(C(N2C(=O)C)C#N)C(=O)OC)[H])[H])cccc1 |
| SPLASH |
splash10-01oy-8629000000-deb9481b6f4fb331ea04 |
| Source of Spectrum |
AJ-62-812-13 |
| Synonyms |
1-Acetyl-2-(2-hydroxyphenyl)-3,4-trans-dimethoxycarbonyl-5-cyano-perhydropyrrole
Dimethyl (4S,5S)-1-acetyl-2-cyano-5-(2-hydroxyphenyl)-3,4-pyrrolidinedicarboxylate
Steroisomer1-acetyl-2-(2-hydroxyphenyl)-3,4-trans-dimethoxycarbonyl-5-cyano-perhydropyrrole |
| Wiley ID |
1339094 |
