| SpectraBase Spectrum ID |
3UfJ1DjIGG2 |
| Name |
1H-Indole-2-acetic acid, 3-[2-(5-acetyl-3,4-dihydro-1(2H)-pyridinyl)ethyl]-.alpha.-methylene-, methyl ester |
| Alternate Name(s) |
19-Oxosecodine
Methyl 2-{3-[2-(5-acetyl-3,4-dihydro-1(2H)-pyridinyl)ethyl]-1H-indol-2-yl}acrylate |
| CAS Registry Number |
89118-02-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24N2O3 |
| InChI |
InChI=1S/C21H24N2O3/c1-14(21(25)26-3)20-18(17-8-4-5-9-19(17)22-20)10-12-23-11-6-7-16(13-23)15(2)24/h4-5,8-9,13,22H,1,6-7,10-12H2,2-3H3 |
| InChIKey |
ZEDBVGUNYLWCIB-UHFFFAOYSA-N |
| Molecular Weight |
352.434 g/mol |
| SMILES |
[nH]1c2ccccc2c(c1C(C(=O)OC)=C)CCN1C=C(C(=O)C)CCC1 |
| SPLASH |
splash10-0udr-0859000000-01d96ccbd6364ce57e76 |
| Source of Spectrum |
F-39-3717-0 |
| Wiley ID |
1343435 |
![1H-Indole-2-acetic acid, 3-[2-(5-acetyl-3,4-dihydro-1(2H)-pyridinyl)ethyl]-.alpha.-methylene-, methyl ester](/api/spectrum/3UfJ1DjIGG2/structure.png?h=300&w=458 "1H-Indole-2-acetic acid, 3-[2-(5-acetyl-3,4-dihydro-1(2H)-pyridinyl)ethyl]-.alpha.-methylene-, methyl ester")
