| SpectraBase Spectrum ID |
GtAE2foR5ck |
| Name |
o-Benzyl-N,N-dibenzoyl-2,5-diamino-4-(1-(methoxycarbonyl)-2-oxopropyl)phenol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
536.194736624 u |
| Formula |
C32H28N2O6 |
| InChI |
InChI=1S/C32H28N2O6/c1-21(35)29(32(38)39-2)25-18-26(33)28(40-20-22-12-6-3-7-13-22)19-27(25)34(30(36)23-14-8-4-9-15-23)31(37)24-16-10-5-11-17-24/h3-19,29H,20,33H2,1-2H3 |
| InChIKey |
PJWBBNBGFWMUFR-UHFFFAOYSA-N |
| Molecular Weight |
536.584 g/mol |
| SMILES |
C1(N(C(=O)C2=CC=CC=C2)C(=O)C2=CC=CC=C2)=C(C(C(=O)OC)C(=O)C)C=C(C(=C1)OCC=1C=CC=CC1)N |
