| SpectraBase Spectrum ID |
JLKmI7ZoMGo |
| Name |
4-(4-Chlorophenyl)-2-pentyl-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H34ClF2N3 |
| InChI |
InChI=1S/C35H34ClF2N3/c1-2-3-4-5-28-22-29(25-6-12-30(36)13-7-25)23-34(33(28)24-39)40-18-20-41(21-19-40)35(26-8-14-31(37)15-9-26)27-10-16-32(38)17-11-27/h6-17,22-23,35H,2-5,18-21H2,1H3 |
| InChIKey |
OZSDRZGKQDFRQW-UHFFFAOYSA-N |
| Molecular Weight |
570.128 g/mol |
| SMILES |
c1(c(c(CCCCC)cc(c1)-c1ccc(cc1)Cl)C#N)N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F |
| SPLASH |
splash10-00y0-0000090000-b2097c687277680d3cd0 |
| Source of Spectrum |
K-2001-1958-6 |
| Synonyms |
2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-4-(4-chlorophenyl)-6-pentylbenzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-pentylbenzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-pentyl-benzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-pentyl-benzenecarbonitrile |
| Wiley ID |
1579546 |
![4-(4-Chlorophenyl)-2-pentyl-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile](/api/spectrum/JLKmI7ZoMGo/structure.png?h=300&w=458 "4-(4-Chlorophenyl)-2-pentyl-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile")
