| SpectraBase Spectrum ID |
AlNcIgsAQCj |
| Name |
3-[[(2,6-dichlorophenyl)-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
379.074198873 u |
| Formula |
C19H19Cl2NO3 |
| InChI |
InChI=1S/C19H19Cl2NO3/c1-3-25-17(23)11-16(13-9-7-12(2)8-10-13)22-19(24)18-14(20)5-4-6-15(18)21/h4-10,16H,3,11H2,1-2H3,(H,22,24) |
| InChIKey |
RKVKDZDOTILYPW-UHFFFAOYSA-N |
| Molecular Weight |
380.271 g/mol |
| SMILES |
C=1C=C(C=CC1C(CC(OCC)=O)NC(=O)C=1C(=CC=CC1Cl)Cl)C |