| SpectraBase Spectrum ID |
2nnaLOyQqjC |
| Name |
(4-{[(8-allyl-2-oxo-2H-chromen-3-yl)carbonyl]amino}phenyl)acetic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.110672646 u |
| Formula |
C21H17NO5 |
| InChI |
InChI=1S/C21H17NO5/c1-2-4-14-5-3-6-15-12-17(21(26)27-19(14)15)20(25)22-16-9-7-13(8-10-16)11-18(23)24/h2-3,5-10,12H,1,4,11H2,(H,22,25)(H,23,24) |
| InChIKey |
NBGQYJMBCSSFDL-UHFFFAOYSA-N |
| Molecular Weight |
363.369 g/mol |
| SMILES |
C=1(C(OC2=C(C1)C=CC=C2CC=C)=O)C(NC1=CC=C(CC(=O)O)C=C1)=O |
![(4-{[(8-allyl-2-oxo-2H-chromen-3-yl)carbonyl]amino}phenyl)acetic acid](/api/spectrum/2nnaLOyQqjC/structure.png?h=300&w=458 "(4-{[(8-allyl-2-oxo-2H-chromen-3-yl)carbonyl]amino}phenyl)acetic acid")
