| SpectraBase Spectrum ID |
63M2DhvgMV8 |
| Name |
2,5-Dimethyl-3-methoxycarbonyl-4-[(4-methoxyphenyl)aminocarbonyl]-1-[N-(tert-butoxycarbonyl)amino]pyrrole |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.189985595 u |
| Formula |
C21H27N3O6 |
| InChI |
InChI=1S/C21H27N3O6/c1-12-16(18(25)22-14-8-10-15(28-6)11-9-14)17(19(26)29-7)13(2)24(12)23-20(27)30-21(3,4)5/h8-11H,1-7H3,(H,22,25)(H,23,27) |
| InChIKey |
BWVSBBYLZSOFRV-UHFFFAOYSA-N |
| Molecular Weight |
417.462 g/mol |
| SMILES |
C=1(N(C(=C(C1C(=O)OC)C(=O)NC=1C=CC(=CC1)OC)C)NC(=O)OC(C)(C)C)C |
![2,5-Dimethyl-3-methoxycarbonyl-4-[(4-methoxyphenyl)aminocarbonyl]-1-[N-(tert-butoxycarbonyl)amino]pyrrole](/api/spectrum/63M2DhvgMV8/structure.png?h=300&w=458 "2,5-Dimethyl-3-methoxycarbonyl-4-[(4-methoxyphenyl)aminocarbonyl]-1-[N-(tert-butoxycarbonyl)amino]pyrrole")
