SpectraBase Spectrum ID |
AryjWD2aD8I |
Name |
11-Phenyl-N,1-di-4-tolyl-2,3,5,6,8,9-hexahydro-1H-imidazo[1,5-D][1,9,4,6]dioxadiazacycloundecene-13-amine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
468.252526284 u |
Formula |
C29H32N4O2 |
InChI |
InChI=1S/C29H32N4O2/c1-22-8-12-25(13-9-22)30-27-29-32(26-14-10-23(2)11-15-26)16-18-34-20-21-35-19-17-33(29)28(31-27)24-6-4-3-5-7-24/h3-15,30H,16-21H2,1-2H3 |
InChIKey |
OBFPUPPTRKZCCI-UHFFFAOYSA-N |
Molecular Weight |
468.601 g/mol |
SMILES |
C=12N(C(C=3C=CC=CC3)=NC1NC1=CC=C(C=C1)C)CCOCCOCCN2C1=CC=C(C=C1)C |