SpectraBase Spectrum ID |
HTH8MmzECnE |
Name |
Benzamide, N-[4-(1H-imidazol-1-ylmethyl)phenyl]-2-[[5-methyl-2-(1-methylethyl)phenoxy]methyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
439.225977184 u |
Formula |
C28H29N3O2 |
InChI |
InChI=1S/C28H29N3O2/c1-20(2)25-13-8-21(3)16-27(25)33-18-23-6-4-5-7-26(23)28(32)30-24-11-9-22(10-12-24)17-31-15-14-29-19-31/h4-16,19-20H,17-18H2,1-3H3,(H,30,32) |
InChIKey |
AGZPYKPZKVXPRR-UHFFFAOYSA-N |
Molecular Weight |
439.559 g/mol |
SMILES |
C=1C=C(C(C(=O)NC2=CC=C(C=C2)CN2C=NC=C2)=CC1)COC1=CC(C)=CC=C1C(C)C |