| SpectraBase Spectrum ID |
E3rAI9mVHao |
| Name |
(5E)-5-{1-[(1,3-Benzodioxol-5-ylmethyl)amino]ethylidene}-1-butyl-2,4,6(1H,3H,5H)-pyrimidinetrione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.148120783 u |
| Formula |
C18H21N3O5 |
| InChI |
InChI=1S/C18H21N3O5/c1-3-4-7-21-17(23)15(16(22)20-18(21)24)11(2)19-9-12-5-6-13-14(8-12)26-10-25-13/h5-6,8,19H,3-4,7,9-10H2,1-2H3,(H,20,22,24)/b15-11+ |
| InChIKey |
LUOCFBBNGAVTLZ-RVDMUPIBSA-N |
| Molecular Weight |
359.382 g/mol |
| SMILES |
N(\C(=C\1C(N(C(NC1=O)=O)CCCC)=O)C)CC1=CC=2OCOC2C=C1 |
![(5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-1-butyl-2,4,6(1H,3H,5H)-pyrimidinetrione](/api/spectrum/E3rAI9mVHao/structure.png?h=300&w=458 "(5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-1-butyl-2,4,6(1H,3H,5H)-pyrimidinetrione")
