| SpectraBase Spectrum ID |
AqRG17YFIfV |
| Name |
1H-Pyrrole-3-propanoic acid, 2-[(1,1-dimethylethoxy)carbonyl]-4-(2-methoxy-2-oxoethyl)-5-(2-nitroethenyl)-, methyl ester |
| CAS Registry Number |
113661-73-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24N2O8 |
| InChI |
InChI=1S/C18H24N2O8/c1-18(2,3)28-17(23)16-11(6-7-14(21)26-4)12(10-15(22)27-5)13(19-16)8-9-20(24)25/h8-9,19H,6-7,10H2,1-5H3/b9-8+ |
| InChIKey |
QXKQMRUMDHZCGU-CMDGGOBGSA-N |
| Molecular Weight |
396.396 g/mol |
| SMILES |
[nH]1c(c(c(c1C(OC(C)(C)C)=O)CCC(=O)OC)CC(=O)OC)\C=C\N(=O)=O |
| SPLASH |
splash10-0002-0079000000-583828f9896e283acef7 |
| Source of Spectrum |
KC-1987-1676-43 |
| Synonyms |
t-Butyl 3-(2-methoxycarbonylethyl)-4-methoxycarbonylmethyl-5-(2-nitrovinyl)pyrrole-2-carboxylate
tert-Butyl 4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-5-[(E)-2-nitroethenyl]-1H-pyrrole-2-carboxylate |
| Wiley ID |
1367292 |
![1H-Pyrrole-3-propanoic acid, 2-[(1,1-dimethylethoxy)carbonyl]-4-(2-methoxy-2-oxoethyl)-5-(2-nitroethenyl)-, methyl ester](/api/spectrum/AqRG17YFIfV/structure.png?h=300&w=458 "1H-Pyrrole-3-propanoic acid, 2-[(1,1-dimethylethoxy)carbonyl]-4-(2-methoxy-2-oxoethyl)-5-(2-nitroethenyl)-, methyl ester")
