| SpectraBase Spectrum ID |
GWzZsW8ni2s |
| Name |
3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-(3-thienyl)-, 2-methoxyethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.119129330 u |
| Formula |
C18H21NO4S |
| InChI |
InChI=1S/C18H21NO4S/c1-11-15(18(21)23-8-7-22-2)16(12-6-9-24-10-12)17-13(19-11)4-3-5-14(17)20/h6,9-10,16,19H,3-5,7-8H2,1-2H3 |
| InChIKey |
MLZXPNCCKXHGIT-UHFFFAOYSA-N |
| Molecular Weight |
347.429 g/mol |
| SMILES |
N1C(=C(C(C=2C(CCCC12)=O)C1=CSC=C1)C(=O)OCCOC)C |
