![N-(2-butyl-3-propyl-4-quinolinyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]acetamide](/api/spectrum/EkDKwIVkej5/structure.png?h=300&w=458 "N-(2-butyl-3-propyl-4-quinolinyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]acetamide")
| SpectraBase Compound ID | 7OxrS4Hdtk6 |
|---|---|
| InChI | InChI=1S/C27H34N4O3/c1-3-5-11-22-20(9-4-2)26(21-10-6-7-12-23(21)28-22)29-25(32)19-30-14-16-31(17-15-30)27(33)24-13-8-18-34-24/h6-8,10,12-13,18H,3-5,9,11,14-17,19H2,1-2H3,(H,28,29,32) |
| InChIKey | AGLKMKIRVTZKQI-UHFFFAOYSA-N |
| Mol Weight | 462.6 g/mol |
| Molecular Formula | C27H34N4O3 |
| Exact Mass | 462.263091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkDKwIVkej5 |
|---|---|
| Name | N-(2-Butyl-3-propyl-4-quinolinyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 462.263090968 u |
| Formula | C27H34N4O3 |
| InChI | InChI=1S/C27H34N4O3/c1-3-5-11-22-20(9-4-2)26(21-10-6-7-12-23(21)28-22)29-25(32)19-30-14-16-31(17-15-30)27(33)24-13-8-18-34-24/h6-8,10,12-13,18H,3-5,9,11,14-17,19H2,1-2H3,(H,28,29,32) |
| InChIKey | AGLKMKIRVTZKQI-UHFFFAOYSA-N |
| Molecular Weight | 462.594 g/mol |
| SMILES | C=1(C(=C(CCCC)N=C2C1C=CC=C2)CCC)NC(CN1CCN(C(C=2OC=CC2)=O)CC1)=O |