| SpectraBase Spectrum ID |
LUYeC3Gievc |
| Name |
(2R)-2-[(2R)-2-(4,4-Diethoxybutylamino)heptyl]-1-piperidinecarboxylic acid (phenylmethyl) ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
476.361408030 u |
| Formula |
C28H48N2O4 |
| InChI |
InChI=1S/C28H48N2O4/c1-4-7-9-17-25(29-20-14-19-27(32-5-2)33-6-3)22-26-18-12-13-21-30(26)28(31)34-23-24-15-10-8-11-16-24/h8,10-11,15-16,25-27,29H,4-7,9,12-14,17-23H2,1-3H3/t25-,26-/m1/s1 |
| InChIKey |
ZPHUVOUNCMNNBF-CLJLJLNGSA-N |
| Molecular Weight |
476.702 g/mol |
| SMILES |
C(N1[C@@](C[C@](NCCCC(OCC)OCC)(CCCCC)[H])(CCCC1)[H])(OCC1=CC=CC=C1)=O |
![(2R)-2-[(2R)-2-(4,4-diethoxybutylamino)heptyl]-1-piperidinecarboxylic acid (phenylmethyl) ester](/api/spectrum/LUYeC3Gievc/structure.png?h=300&w=458 "(2R)-2-[(2R)-2-(4,4-diethoxybutylamino)heptyl]-1-piperidinecarboxylic acid (phenylmethyl) ester")
