| SpectraBase Spectrum ID |
ovuzC7OIEm |
| Name |
1-[(3-Ethoxy-3-keto-propanoyl)amino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.158685467 u |
| Formula |
C20H23N3O6 |
| InChI |
InChI=1S/C20H23N3O6/c1-5-29-16(25)11-15(24)22-23-12(2)17(18(13(23)3)20(27)28-4)19(26)21-14-9-7-6-8-10-14/h6-10H,5,11H2,1-4H3,(H,21,26)(H,22,24) |
| InChIKey |
QFHKOATXEORXLW-UHFFFAOYSA-N |
| Molecular Weight |
401.419 g/mol |
| SMILES |
C=1(C(=C(C)N(C1C)NC(CC(=O)OCC)=O)C(=O)OC)C(NC=1C=CC=CC1)=O |
![1-[(3-Ethoxy-3-keto-propanoyl)amino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylic acid methyl ester](/api/spectrum/ovuzC7OIEm/structure.png?h=300&w=458 "1-[(3-Ethoxy-3-keto-propanoyl)amino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylic acid methyl ester")
