| SpectraBase Spectrum ID |
9SA3Muk90H7 |
| Name |
1-Acetyl-6-(p-cyanophenyl)-2-{N-[2'-(3''-indolyl)ethyl]amino}-4-phenyl-cyclohexa-1,3-diene |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
457.215412500 u |
| Formula |
C31H27N3O |
| InChI |
InChI=1S/C31H27N3O/c1-21(35)31-28(24-13-11-22(19-32)12-14-24)17-26(23-7-3-2-4-8-23)18-30(31)33-16-15-25-20-34-29-10-6-5-9-27(25)29/h2-14,18,20,28,33-34H,15-17H2,1H3 |
| InChIKey |
ILDQJVPRAFRMHY-UHFFFAOYSA-N |
| Molecular Weight |
457.577 g/mol |
| SMILES |
C1(=C(C=C(CC1C=1C=CC(C#N)=CC1)C1=CC=CC=C1)NCCC1=CNC2=C1C=CC=C2)C(=O)C |
![1-Acetyl-6-(p-cyanophenyl)-2-{N-[2'-(3"-indolyl)ethyl]amino}-4-phenyl-cyclohexa-1,3-diene](/api/spectrum/9SA3Muk90H7/structure.png?h=300&w=458 "1-Acetyl-6-(p-cyanophenyl)-2-{N-[2'-(3\"-indolyl)ethyl]amino}-4-phenyl-cyclohexa-1,3-diene")
