| SpectraBase Spectrum ID |
hdaw9UuIco |
| Name |
Methyl 5-ethyl-1-methyl-2-[1-(phenylsulfonyl)-2-indolyl]-piperidine-4-acetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
454.192628624 u |
| Formula |
C25H30N2O4S |
| InChI |
InChI=1S/C25H30N2O4S/c1-4-18-17-26(2)23(15-20(18)16-25(28)31-3)24-14-19-10-8-9-13-22(19)27(24)32(29,30)21-11-6-5-7-12-21/h5-14,18,20,23H,4,15-17H2,1-3H3 |
| InChIKey |
HFJFBGBBEQNCBW-UHFFFAOYSA-N |
| Molecular Weight |
454.585 g/mol |
| SMILES |
C=1(S(N2C(C3N(CC(C(C3)CC(=O)OC)CC)C)=CC3=C2C=CC=C3)(=O)=O)C=CC=CC1 |
![Methyl 5-ethyl-1-methyl-2-[1-(phenylsulfonyl)-2-indolyl]-piperidine-4-acetate](/api/spectrum/hdaw9UuIco/structure.png?h=300&w=458 "Methyl 5-ethyl-1-methyl-2-[1-(phenylsulfonyl)-2-indolyl]-piperidine-4-acetate")
