| SpectraBase Spectrum ID |
Br1y7GSZW6S |
| Name |
2(1H)-Isoquinolinecarboxylic acid, 1-[(2-bromo-5-hydroxyphenyl)methylene]-3,4-dihydro-5-hydroxy-6,7-dimethoxy-, ethyl ester |
| CAS Registry Number |
121949-66-4 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22BrNO6 |
| InChI |
InChI=1S/C21H22BrNO6/c1-4-29-21(26)23-8-7-14-15(11-18(27-2)20(28-3)19(14)25)17(23)10-12-9-13(24)5-6-16(12)22/h5-6,9-11,24-25H,4,7-8H2,1-3H3/b17-10+ |
| InChIKey |
QGCMWLKPGSIDMR-LICLKQGHSA-N |
| Molecular Weight |
464.312 g/mol |
| SMILES |
Oc1c(c(cc2c1CCN(\C2=C/c1cc(ccc1Br)O)C(=O)OCC)OC)OC |
| SPLASH |
splash10-03xs-0039600000-6a01db010d961e35a35d |
| Source of Spectrum |
Y-25-1564-8 |
| Synonyms |
1-(2'-Bromo-5'-hydroxybenzylidene)-2-ethoxycarbonyl-6,7-dimethoxy-5-hydroxy-1,2,3,4-terahydroisoquinoline
Ethyl (1E)-1-(2-bromo-5-hydroxybenzylidene)-5-hydroxy-6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinecarboxylate |
| Wiley ID |
1391275 |
![2(1H)-Isoquinolinecarboxylic acid, 1-[(2-bromo-5-hydroxyphenyl)methylene]-3,4-dihydro-5-hydroxy-6,7-dimethoxy-, ethyl ester](/api/spectrum/Br1y7GSZW6S/structure.png?h=300&w=458 "2(1H)-Isoquinolinecarboxylic acid, 1-[(2-bromo-5-hydroxyphenyl)methylene]-3,4-dihydro-5-hydroxy-6,7-dimethoxy-, ethyl ester")
