| SpectraBase Spectrum ID |
DLSimDb75M1 |
| Name |
Butanoic acid, 4-[(2-chlorophenyl)amino]-4-oxo-, 2-(4-methoxyphenyl)-2-oxoethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
375.087350379 u |
| Formula |
C19H18ClNO5 |
| InChI |
InChI=1S/C19H18ClNO5/c1-25-14-8-6-13(7-9-14)17(22)12-26-19(24)11-10-18(23)21-16-5-3-2-4-15(16)20/h2-9H,10-12H2,1H3,(H,21,23) |
| InChIKey |
NERFVVKRBBCFQF-UHFFFAOYSA-N |
| Molecular Weight |
375.808 g/mol |
| SMILES |
N(C(=O)CCC(OCC(C1=CC=C(C=C1)OC)=O)=O)C=1C(Cl)=CC=CC1 |
![Butanoic acid, 4-[(2-chlorophenyl)amino]-4-oxo-, 2-(4-methoxyphenyl)-2-oxoethyl ester](/api/spectrum/DLSimDb75M1/structure.png?h=300&w=458 "Butanoic acid, 4-[(2-chlorophenyl)amino]-4-oxo-, 2-(4-methoxyphenyl)-2-oxoethyl ester")
