| SpectraBase Spectrum ID |
Kk71k4yk6To |
| Name |
(Phenylmethyl) 2-[[(Z)-2-benzamido-3-(4-fluorophenyl)prop-2-enoyl]amino]ethanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.148535323 u |
| Formula |
C25H21FN2O4 |
| InChI |
InChI=1S/C25H21FN2O4/c26-21-13-11-18(12-14-21)15-22(28-24(30)20-9-5-2-6-10-20)25(31)27-16-23(29)32-17-19-7-3-1-4-8-19/h1-15H,16-17H2,(H,27,31)(H,28,30)/b22-15- |
| InChIKey |
OIIGUBIRPLLJPL-JCMHNJIXSA-N |
| Molecular Weight |
432.451 g/mol |
| SMILES |
C1=C(C=CC=C1)C(N\C(=C/C1=CC=C(C=C1)F)C(NCC(OCC1=CC=CC=C1)=O)=O)=O |
![(phenylmethyl) 2-[[(Z)-2-benzamido-3-(4-fluorophenyl)prop-2-enoyl]amino]ethanoate](/api/spectrum/Kk71k4yk6To/structure.png?h=300&w=458 "(phenylmethyl) 2-[[(Z)-2-benzamido-3-(4-fluorophenyl)prop-2-enoyl]amino]ethanoate")
