| SpectraBase Spectrum ID |
HZllGWztVsw |
| Name |
4-(6-Bromo-2-keto-chromene-3-carbonyl)piperazine-1-carboxylic acid ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
408.032084650 u |
| Formula |
C17H17BrN2O5 |
| InChI |
InChI=1S/C17H17BrN2O5/c1-2-24-17(23)20-7-5-19(6-8-20)15(21)13-10-11-9-12(18)3-4-14(11)25-16(13)22/h3-4,9-10H,2,5-8H2,1H3 |
| InChIKey |
QCMRKWYQWVJQJC-UHFFFAOYSA-N |
| Molecular Weight |
409.236 g/mol |
| SMILES |
CCOC(N1CCN(C(C=2C(=O)OC3=C(C2)C=C(C=C3)Br)=O)CC1)=O |
