| SpectraBase Spectrum ID |
KBZoxObdo8C |
| Name |
1H-Pyrrolo[1,2-c]imidazolium, 5,7-bis(ethoxycarbonyl)-2,6-dimethyl-3-phenyl-, hydroxide, inner salt |
| CAS Registry Number |
124857-22-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22N2O4 |
| InChI |
InChI=1S/C20H22N2O4/c1-5-25-19(23)16-13(3)17(20(24)26-6-2)22-15(16)12-21(4)18(22)14-10-8-7-9-11-14/h7-12H,5-6H2,1-4H3 |
| InChIKey |
IAQARAGMBXVUBD-UHFFFAOYSA-N |
| Molecular Weight |
354.406 g/mol |
| SMILES |
c12[n](\C(C(=C2C(=O)OCC)C)=C\([O-])OCC)c([n+](c1)C)-c1ccccc1 |
| SPLASH |
splash10-0udi-0029000000-97d28f674955bd187745 |
| Source of Spectrum |
J-55-915-10 |
| Synonyms |
(E)-ethoxy[7-(ethoxycarbonyl)-2,6-dimethyl-3-phenyl-5H-pyrrolo[1,2-c]imidazol-2-ium-5-ylidene]methanolate
Pyrrolo[1,2-c]imidazole mesomeric betaine |
| Wiley ID |
1344606 |
![1H-Pyrrolo[1,2-c]imidazolium, 5,7-bis(ethoxycarbonyl)-2,6-dimethyl-3-phenyl-, hydroxide, inner salt](/api/spectrum/KBZoxObdo8C/structure.png?h=300&w=458 "1H-Pyrrolo[1,2-c]imidazolium, 5,7-bis(ethoxycarbonyl)-2,6-dimethyl-3-phenyl-, hydroxide, inner salt")
