| SpectraBase Spectrum ID |
COfn2XqkhL3 |
| Name |
Butanoic acid, 4-[[2-(4-morpholinylsulfonyl)ethyl](2-pyridinylmethyl)amino]-4-oxo- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
385.130756641 u |
| Formula |
C16H23N3O6S |
| InChI |
InChI=1S/C16H23N3O6S/c20-15(4-5-16(21)22)18(13-14-3-1-2-6-17-14)9-12-26(23,24)19-7-10-25-11-8-19/h1-3,6H,4-5,7-13H2,(H,21,22) |
| InChIKey |
WVIYHUYRFMSGKF-UHFFFAOYSA-N |
| Molecular Weight |
385.435 g/mol |
| SMILES |
OC(CCC(N(CCS(N1CCOCC1)(=O)=O)CC1=NC=CC=C1)=O)=O |