![6'-Chloro-2-(p-chlorophenoxy)-4'-{[3-(diethylamino)propyl]crabamoyl}-m-acetanisidide](/api/spectrum/C7nhUX9JXMI/structure.png?h=300&w=458 "6'-Chloro-2-(p-chlorophenoxy)-4'-{[3-(diethylamino)propyl]crabamoyl}-m-acetanisidide")
| SpectraBase Compound ID | ISlDmNCTyso |
|---|---|
| InChI | InChI=1S/C23H29Cl2N3O4/c1-4-28(5-2)12-6-11-26-23(30)18-13-19(25)20(14-21(18)31-3)27-22(29)15-32-17-9-7-16(24)8-10-17/h7-10,13-14H,4-6,11-12,15H2,1-3H3,(H,26,30)(H,27,29) |
| InChIKey | ZKYKSYVXIGIJKD-UHFFFAOYSA-N |
| Mol Weight | 482.41 g/mol |
| Molecular Formula | C23H29Cl2N3O4 |
| Exact Mass | 481.153512 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C7nhUX9JXMI |
|---|---|
| Name | 6'-Chloro-2-(p-chlorophenoxy)-4'-{[3-(diethylamino)propyl]crabamoyl}-m-acetanisidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 481.153511822 u |
| Formula | C23H29Cl2N3O4 |
| InChI | InChI=1S/C23H29Cl2N3O4/c1-4-28(5-2)12-6-11-26-23(30)18-13-19(25)20(14-21(18)31-3)27-22(29)15-32-17-9-7-16(24)8-10-17/h7-10,13-14H,4-6,11-12,15H2,1-3H3,(H,26,30)(H,27,29) |
| InChIKey | ZKYKSYVXIGIJKD-UHFFFAOYSA-N |
| Molecular Weight | 482.408 g/mol |
| SMILES | N(C(C1=CC(=C(C=C1OC)NC(COC=1C=CC(=CC1)Cl)=O)Cl)=O)CCCN(CC)CC |