| SpectraBase Spectrum ID |
GZu2tx4pw5X |
| Name |
6-(4-Chlorophenyl)-2-keto-4-[4-(2-methoxyphenyl)piperazino]pyran-3-carbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
421.119319213 u |
| Formula |
C23H20ClN3O3 |
| InChI |
InChI=1S/C23H20ClN3O3/c1-29-21-5-3-2-4-19(21)26-10-12-27(13-11-26)20-14-22(30-23(28)18(20)15-25)16-6-8-17(24)9-7-16/h2-9,14H,10-13H2,1H3 |
| InChIKey |
DSRFBUJEFBGYCN-UHFFFAOYSA-N |
| Molecular Weight |
421.884 g/mol |
| SMILES |
C1(=C(C=C(OC1=O)C=1C=CC(=CC1)Cl)N1CCN(CC1)C=1C(OC)=CC=CC1)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834958 |
![6-(4-Chlorophenyl)-2-keto-4-[4-(2-methoxyphenyl)piperazino]pyran-3-carbonitrile](/api/spectrum/GZu2tx4pw5X/structure.png?h=300&w=458 "6-(4-Chlorophenyl)-2-keto-4-[4-(2-methoxyphenyl)piperazino]pyran-3-carbonitrile")
