SpectraBase Spectrum ID |
1tcuGyvki4X |
Name |
3-[(4-Tert-butylbenzoyl)amino]-3-(4-isopropoxyphenyl)propanoic acid |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
383.209658414 u |
Formula |
C23H29NO4 |
InChI |
InChI=1S/C23H29NO4/c1-15(2)28-19-12-8-16(9-13-19)20(14-21(25)26)24-22(27)17-6-10-18(11-7-17)23(3,4)5/h6-13,15,20H,14H2,1-5H3,(H,24,27)(H,25,26) |
InChIKey |
BGCZNYOUKVKODC-UHFFFAOYSA-N |
Molecular Weight |
383.488 g/mol |
SMILES |
C=1C=C(C=CC1C(CC(O)=O)NC(=O)C1=CC=C(C=C1)C(C)(C)C)OC(C)C |