| SpectraBase Spectrum ID |
6s38zDWphZM |
| Name |
4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}-3-methyl-2-(4-methylphenyl)quinoline |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
479.220891803 u |
| Formula |
C30H29N3O3 |
| InChI |
InChI=1S/C30H29N3O3/c1-20-7-10-23(11-8-20)29-21(2)28(24-5-3-4-6-25(24)31-29)30(34)33-15-13-32(14-16-33)18-22-9-12-26-27(17-22)36-19-35-26/h3-12,17H,13-16,18-19H2,1-2H3 |
| InChIKey |
WSNLEFMTOZLIAU-UHFFFAOYSA-N |
| Molecular Weight |
479.580 g/mol |
| SMILES |
C1(C(N2CCN(CC2)CC2=CC=3OCOC3C=C2)=O)=C(C(C2=CC=C(C=C2)C)=NC2=C1C=CC=C2)C |
![4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}-3-methyl-2-(4-methylphenyl)quinoline](/api/spectrum/6s38zDWphZM/structure.png?h=300&w=458 "4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}-3-methyl-2-(4-methylphenyl)quinoline")
