| SpectraBase Spectrum ID |
CviZEsVgQY0 |
| Name |
Pentanedioic acid, 3-[2-[5-[(1,1-dimethylethoxy)carbonyl]-3,4-dimethyl-1H-pyrrol-2-yl]-1 -nitroethyl]-3-methyl-, dimethyl ester |
| CAS Registry Number |
90702-49-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32N2O8 |
| InChI |
InChI=1S/C21H32N2O8/c1-12-13(2)18(19(26)31-20(3,4)5)22-14(12)9-15(23(27)28)21(6,10-16(24)29-7)11-17(25)30-8/h15,22H,9-11H2,1-8H3 |
| InChIKey |
IIMYOJOXSCJDPR-UHFFFAOYSA-N |
| Molecular Weight |
440.493 g/mol |
| SMILES |
[nH]1c(c(c(c1CC(N(=O)=O)C(CC(=O)OC)(CC(=O)OC)C)C)C)C(OC(C)(C)C)=O |
| SPLASH |
splash10-05u2-7943100000-a9e0e2e8d7b7f8d78ca7 |
| Source of Spectrum |
AH-115-108-0 |
| Synonyms |
Dimethyl 3-{2-[5-(tert-butoxycarbonyl)-3,4-dimethyl-1H-pyrrol-2-yl]-1-nitroethyl}-3-methylpentanedioate
tert-Butyl ester of 3,4-dimethyl-5-(3,3-bis-methoxycarbonylmethyl-2-nitrobutyl)-pyrrol-2-carboxylic acid |
| Wiley ID |
1384593 |
![Pentanedioic acid, 3-[2-[5-[(1,1-dimethylethoxy)carbonyl]-3,4-dimethyl-1H-pyrrol-2-yl]-1 -nitroethyl]-3-methyl-, dimethyl ester](/api/spectrum/CviZEsVgQY0/structure.png?h=300&w=458 "Pentanedioic acid, 3-[2-[5-[(1,1-dimethylethoxy)carbonyl]-3,4-dimethyl-1H-pyrrol-2-yl]-1 -nitroethyl]-3-methyl-, dimethyl ester")
