| SpectraBase Spectrum ID |
CgoPZsZQR1g |
| Name |
8-Methyl-2-({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}acetyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-B]indole |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
456.213695993 u |
| Formula |
C25H27F3N4O |
| InChI |
InChI=1S/C25H27F3N4O/c1-17-5-6-22-20(13-17)21-15-32(8-7-23(21)29-22)24(33)16-30-9-11-31(12-10-30)19-4-2-3-18(14-19)25(26,27)28/h2-6,13-14,29H,7-12,15-16H2,1H3 |
| InChIKey |
YPKBHMAMJWWHLF-UHFFFAOYSA-N |
| Molecular Weight |
456.513 g/mol |
| SMILES |
N1C=2C(C3=C1CCN(C3)C(CN1CCN(CC1)C=1C=C(C(F)(F)F)C=CC1)=O)=CC(=CC2)C |
![8-methyl-2-({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}acetyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole](/api/spectrum/CgoPZsZQR1g/structure.png?h=300&w=458 "8-methyl-2-({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}acetyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole")
