| SpectraBase Spectrum ID |
ZKveflEzc8 |
| Name |
(2Z)-2-(3-{[(tert-Butoxycarbonyl)amino]methyl}benzylidene)-3-oxo-2,3-dihydrobenzo[b]thiophene-7-carboxylic acid |
| Alternate Name(s) |
(2Z)-2-(3-{[(tert-butoxycarbonyl)amino]methyl}benzylidene)-3-oxo-2,3-dihydro-1-benzothiophene-7-carboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H21NO5S |
| InChI |
InChI=1S/C22H21NO5S/c1-22(2,3)28-21(27)23-12-14-7-4-6-13(10-14)11-17-18(24)15-8-5-9-16(20(25)26)19(15)29-17/h4-11H,12H2,1-3H3,(H,23,27)(H,25,26)/b17-11- |
| InChIKey |
AJFINDBFUMJSKN-BOPFTXTBSA-N |
| Molecular Weight |
411.472 g/mol |
| SMILES |
N(Cc1cc(\C=C\2C(c3c(c(C(=O)O)ccc3)S2)=O)ccc1)C(=O)OC(C)(C)C |
| SPLASH |
splash10-0a4j-9050000000-8fba1e26f554157ae65b |
| Source of Spectrum |
F4-0-3298-1 |
| Wiley ID |
1619100 |
![(2Z)-2-(3-{[(tert-Butoxycarbonyl)amino]methyl}benzylidene)-3-oxo-2,3-dihydrobenzo[b]thiophene-7-carboxylic acid](/api/spectrum/ZKveflEzc8/structure.png?h=300&w=458 "(2Z)-2-(3-{[(tert-Butoxycarbonyl)amino]methyl}benzylidene)-3-oxo-2,3-dihydrobenzo[b]thiophene-7-carboxylic acid")
