| SpectraBase Spectrum ID |
Dmlz9ueMNAt |
| Name |
5-Acetyl-7-methoxy-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-2-carboxylic acid ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.142307128 u |
| Formula |
C17H20N2O4 |
| InChI |
InChI=1S/C17H20N2O4/c1-4-23-17(21)16-11-7-8-19(10(2)20)9-12-14(22-3)6-5-13(18-16)15(11)12/h5-6,18H,4,7-9H2,1-3H3 |
| InChIKey |
CEWUTGIJPNXUCZ-UHFFFAOYSA-N |
| Molecular Weight |
316.357 g/mol |
| SMILES |
C12=C(NC3=C2C(CN(CC1)C(=O)C)=C(OC)C=C3)C(=O)OCC |
![5-Acetyl-7-methoxy-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-2-carboxylic acid ethyl ester](/api/spectrum/Dmlz9ueMNAt/structure.png?h=300&w=458 "5-Acetyl-7-methoxy-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-2-carboxylic acid ethyl ester")
