| SpectraBase Spectrum ID |
LlFVwHAP1YK |
| Name |
Diethyl 2-{[3'-(2""""-amino)ethyl]-1H-indol-2'-yl}-2-methylmalonate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.226036752 u |
| Formula |
C23H32N2O6 |
| InChI |
InChI=1S/C23H32N2O6/c1-7-29-19(26)23(6,20(27)30-8-2)18-16(15-11-9-10-12-17(15)25-18)13-14-24-21(28)31-22(3,4)5/h9-12,25H,7-8,13-14H2,1-6H3,(H,24,28) |
| InChIKey |
DVBRIHJLNMDXIS-UHFFFAOYSA-N |
| Molecular Weight |
432.517 g/mol |
| SMILES |
C=1(C(C(=O)OCC)(C(=O)OCC)C)NC2=CC=CC=C2C1CCNC(OC(C)(C)C)=O |
![Diethyl 2-{[3'-(2""""-<T-butoxycarbonyl>amino)ethyl]-1H-indol-2'-yl}-2-methylmalonate](/api/spectrum/LlFVwHAP1YK/structure.png?h=300&w=458 "Diethyl 2-{[3'-(2\"\"\"\"-<T-butoxycarbonyl>amino)ethyl]-1H-indol-2'-yl}-2-methylmalonate")
