| SpectraBase Spectrum ID |
1ojbrT9V5cF |
| Name |
5-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)methyl-(4-fluorophenyl)amino]-5-oxidanylidene-pentanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25FN2O5 |
| InChI |
InChI=1S/C21H25FN2O5/c1-4-29-21(28)20-13(2)17(14(3)23-20)12-24(16-10-8-15(22)9-11-16)18(25)6-5-7-19(26)27/h8-11,23H,4-7,12H2,1-3H3,(H,26,27) |
| InChIKey |
COPMSAIAOOVTDU-UHFFFAOYSA-N |
| Molecular Weight |
404.438 g/mol |
| SMILES |
[nH]1c(c(c(CN(C(CCCC(=O)O)=O)c2ccc(cc2)F)c1C)C)C(=O)OCC |
| SPLASH |
splash10-001i-7900000000-111a33f7f9772408820f |
| Synonyms |
5-[N-[(5-carbethoxy-2,4-dimethyl-1H-pyrrol-3-yl)methyl]-4-fluoro-anilino]-5-keto-valeric acid
5-[N-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)methyl]-4-fluoro-anilino]-5-oxo-pentanoic acid |
| Wiley ID |
1442549 |
![5-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)methyl-(4-fluorophenyl)amino]-5-oxidanylidene-pentanoic acid](/api/spectrum/1ojbrT9V5cF/structure.png?h=300&w=458 "5-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)methyl-(4-fluorophenyl)amino]-5-oxidanylidene-pentanoic acid")
