| SpectraBase Spectrum ID |
40ZIXVCzR2h |
| Name |
Isocyanic acid, diester with 4,4'-bis(o-hydroxybenzyl)carbanilide; urea, N,N'-bis[4-[(2-isocyanatophenyl)methyl]phenyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
474.169190581 u |
| Formula |
C29H22N4O3 |
| InChI |
InChI=1S/C29H22N4O3/c34-19-30-27-7-3-1-5-23(27)17-21-9-13-25(14-10-21)32-29(36)33-26-15-11-22(12-16-26)18-24-6-2-4-8-28(24)31-20-35/h1-16H,17-18H2,(H2,32,33,36) |
| InChIKey |
TXARYODAGCSWAK-UHFFFAOYSA-N |
| Molecular Weight |
474.520 g/mol |
| SMILES |
N(C1=CC=C(C=C1)CC1=CC=CC=C1N=C=O)C(NC1=CC=C(C=C1)CC1=C(C=CC=C1)N=C=O)=O |
![Isocyanic acid, diester with 4,4'-bis(o-hydroxybenzyl)carbanilide; urea, N,N'-bis[4-[(2-isocyanatophenyl)methyl]phenyl]-](/api/spectrum/40ZIXVCzR2h/structure.png?h=300&w=458 "Isocyanic acid, diester with 4,4'-bis(o-hydroxybenzyl)carbanilide; urea, N,N'-bis[4-[(2-isocyanatophenyl)methyl]phenyl]-")
