| SpectraBase Spectrum ID |
92yotxOkqEm |
| Name |
Butanoic acid, 4-[(4-acetylphenyl)amino]-4-oxo-, 2-(4-bromophenyl)-2-oxoethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
431.036835679 u |
| Formula |
C20H18BrNO5 |
| InChI |
InChI=1S/C20H18BrNO5/c1-13(23)14-4-8-17(9-5-14)22-19(25)10-11-20(26)27-12-18(24)15-2-6-16(21)7-3-15/h2-9H,10-12H2,1H3,(H,22,25) |
| InChIKey |
QALRNAMBHZUKFG-UHFFFAOYSA-N |
| Molecular Weight |
432.270 g/mol |
| SMILES |
N(C(=O)CCC(OCC(C=1C=CC(=CC1)Br)=O)=O)C=1C=CC(C(=O)C)=CC1 |
![Butanoic acid, 4-[(4-acetylphenyl)amino]-4-oxo-, 2-(4-bromophenyl)-2-oxoethyl ester](/api/spectrum/92yotxOkqEm/structure.png?h=300&w=458 "Butanoic acid, 4-[(4-acetylphenyl)amino]-4-oxo-, 2-(4-bromophenyl)-2-oxoethyl ester")
