| SpectraBase Spectrum ID |
9BVkr2X1H1i |
| Name |
1H-Indole-1-acetic acid, 3-[2-[4-(dimethylamino)phenyl]-2-oxoethyl]-2,3-dihydro-3-hydroxy-2-oxo-, ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.168521876 u |
| Formula |
C22H24N2O5 |
| InChI |
InChI=1S/C22H24N2O5/c1-4-29-20(26)14-24-18-8-6-5-7-17(18)22(28,21(24)27)13-19(25)15-9-11-16(12-10-15)23(2)3/h5-12,28H,4,13-14H2,1-3H3 |
| InChIKey |
LSPWEQBCWRDSGX-UHFFFAOYSA-N |
| Molecular Weight |
396.443 g/mol |
| SMILES |
OC1(C(N(C2=C1C=CC=C2)CC(=O)OCC)=O)CC(C1=CC=C(C=C1)N(C)C)=O |
![1H-indole-1-acetic acid, 3-[2-[4-(dimethylamino)phenyl]-2-oxoethyl]-2,3-dihydro-3-hydroxy-2-oxo-, ethyl ester](/api/spectrum/9BVkr2X1H1i/structure.png?h=300&w=458 "1H-indole-1-acetic acid, 3-[2-[4-(dimethylamino)phenyl]-2-oxoethyl]-2,3-dihydro-3-hydroxy-2-oxo-, ethyl ester")
