| SpectraBase Spectrum ID |
96srLkL42oo |
| Name |
1-[1-(4-Iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-4-piperidin-1-yl-piperidine-4-carboxamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
510.112785742 u |
| Formula |
C21H27IN4O3 |
| InChI |
InChI=1S/C21H27IN4O3/c22-15-4-6-16(7-5-15)26-18(27)14-17(19(26)28)24-12-8-21(9-13-24,20(23)29)25-10-2-1-3-11-25/h4-7,17H,1-3,8-14H2,(H2,23,29) |
| InChIKey |
JGTKPJZNVORVPL-UHFFFAOYSA-N |
| Molecular Weight |
510.376 g/mol |
| SMILES |
C1CCN(C2(CCN(C3C(N(C(C3)=O)C3=CC=C(C=C3)I)=O)CC2)C(=O)N)CC1 |
![1-[1-(4-Iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-4-piperidin-1-yl-piperidine-4-carboxamide](/api/spectrum/96srLkL42oo/structure.png?h=300&w=458 "1-[1-(4-Iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-4-piperidin-1-yl-piperidine-4-carboxamide")
