| SpectraBase Spectrum ID |
Jqmrbxa86Bq |
| Name |
Methyl 2-{2'-[(T-butoxycarbonyl)ethyl]amino)sulfonyl]amino}-3-(naphthalen-2""""-yl)propanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.166807798 u |
| Formula |
C21H28N2O6S |
| InChI |
InChI=1S/C21H28N2O6S/c1-21(2,3)29-19(24)11-12-22-30(26,27)23-18(20(25)28-4)14-15-9-10-16-7-5-6-8-17(16)13-15/h5-10,13,18,22-23H,11-12,14H2,1-4H3 |
| InChIKey |
JKAOAQVBCBHALK-UHFFFAOYSA-N |
| Molecular Weight |
436.523 g/mol |
| SMILES |
C(NS(=O)(=O)NCCC(OC(C)(C)C)=O)(C(=O)OC)CC=1C=C2C=CC=CC2=CC1 |
![Methyl 2-{2'-[(T-butoxycarbonyl)ethyl]amino)sulfonyl]amino}-3-(naphthalen-2""""-yl)propanoate](/api/spectrum/Jqmrbxa86Bq/structure.png?h=300&w=458 "Methyl 2-{2'-[(T-butoxycarbonyl)ethyl]amino)sulfonyl]amino}-3-(naphthalen-2\"\"\"\"-yl)propanoate")
