| SpectraBase Spectrum ID |
4MAeekTUsvh |
| Name |
Propanedioic acid, [3-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-2-propenylidene]-, diethyl ester, [S-(E)]- |
| CAS Registry Number |
117652-15-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25N3O5 |
| InChI |
InChI=1S/C21H25N3O5/c1-3-28-20(26)16(21(27)29-4-2)9-7-11-23-19(25)17(22)12-14-13-24-18-10-6-5-8-15(14)18/h5-11,13,17,24H,3-4,12,22H2,1-2H3,(H,23,25)/b11-7+/t17-/m0/s1 |
| InChIKey |
PUUYKUQSSYTOBQ-ZBZNSMLMSA-N |
| Molecular Weight |
399.447 g/mol |
| SMILES |
N(C([C@](Cc1c[nH]c2c1cccc2)(N)[H])=O)\C=C\C=C(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-0079-0509000000-7023b62c5daceaba781d |
| Source of Spectrum |
C-111-307-22 |
| Synonyms |
(S)-3-[2-carbammoyl-2'-((5'-oxo-5'-ethoxy-4'-(ethoxycarbonyl)penta-1',3'-dienyl)amino)ethyl]-1H-indole
Diethyl 2-((2E)-3-{[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino}-2-propenylidene)malonate |
| Wiley ID |
1368956 |
![Propanedioic acid, [3-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-2-propenylidene]-, diethyl ester, [S-(E)]-](/api/spectrum/4MAeekTUsvh/structure.png?h=300&w=458 "Propanedioic acid, [3-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-2-propenylidene]-, diethyl ester, [S-(E)]-")
