SpectraBase Spectrum ID |
El2ms2Mkpr3 |
Name |
4,4'-Iminobis(1-benzamidoanthraquinone) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
667.174335531 u |
Formula |
C42H25N3O6 |
InChI |
InChI=1S/C42H25N3O6/c46-37-25-15-7-9-17-27(25)39(48)35-31(44-41(50)23-11-3-1-4-12-23)21-19-29(33(35)37)43-30-20-22-32(45-42(51)24-13-5-2-6-14-24)36-34(30)38(47)26-16-8-10-18-28(26)40(36)49/h1-22,43H,(H,44,50)(H,45,51) |
InChIKey |
OZMARZSNLQTLII-UHFFFAOYSA-N |
SMILES |
N(C=1C=2C(C=3C=CC=CC3C(C2C(=CC1)NC(C1=CC=CC=C1)=O)=O)=O)C=1C2=C(C(=CC1)NC(C1=CC=CC=C1)=O)C(C=1C=CC=CC1C2=O)=O |