SpectraBase Spectrum ID |
A6rGQNPabDk |
Name |
Benzo[d]1,3-dioxin, 6-carboxylic acid-2,4-dihydro-8-(1-oxido-2-pyridylthiomethyl)-, ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H17NO5S |
InChI |
InChI=1S/C17H17NO5S/c1-2-22-17(19)12-7-13-9-21-11-23-16(13)14(8-12)10-24-15-5-3-4-6-18(15)20/h3-8H,2,9-11H2,1H3 |
InChIKey |
GLXSRKWTMDXDOF-UHFFFAOYSA-N |
Molecular Weight |
347.385 g/mol |
SMILES |
c1cc([n+]([O-])cc1)SCc1c2c(cc(c1)C(=O)OCC)COCO2 |
SPLASH |
splash10-0uec-7957000000-93940ba934d04e4a999f |
Source of Spectrum |
AD-0-2532-0 |
Synonyms |
8-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]-4H-1,3-benzodioxin-6-carboxylic acid ethyl ester
8-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]-4H-1,3-benzodioxin-6-carboxylic acid ethyl ester
Ethyl 8-([(1-oxido-2-pyridinyl)sulfanyl]methyl)-4H-1,3-benzodioxine-6-carboxylate
Ethyl 8-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-4H-1,3-benzodioxine-6-carboxylate
Ethyl 8-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-4H-1,3-benzodioxine-6-carboxylate |
Wiley ID |
1427547 |