2-[4-[5-[1-(4-chlorophenyl)-6,7-dimethoxy-3-methylisoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]piperazin-1-yl]ethanol
Compound with spectra: 1 NMR
![2-[4-[5-[1-(4-chlorophenyl)-6,7-dimethoxy-3-methylisoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]piperazin-1-yl]ethanol](/api/compound/ESHp9IBrAAc.png?ph=true&h=300&w=458 "2-[4-[5-[1-(4-chlorophenyl)-6,7-dimethoxy-3-methylisoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]piperazin-1-yl]ethanol")
| SpectraBase Compound ID | ESHp9IBrAAc |
|---|---|
| InChI | InChI=1S/C26H29ClN6O3/c1-17-14-19-15-22(35-2)23(36-3)16-21(19)24(18-4-6-20(27)7-5-18)33(17)26-28-25(29-30-26)32-10-8-31(9-11-32)12-13-34/h4-7,14-16,34H,8-13H2,1-3H3 |
| InChIKey | NCZFZALUZXJDEX-UHFFFAOYSA-N |
| Mol Weight | 509.01 g/mol |
| Molecular Formula | C26H29ClN6O3 |
| Exact Mass | 508.198967 g/mol |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
diallyl-[5-[1-(4-chlorophenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]amine
diethyl-[5-[1-(4-fluorophenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]amine
[5-[6,7-dimethoxy-1-(4-methoxyphenyl)-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-diethyl-amine
GFKLVYFEWIBJBR-UHFFFAOYSA-N
1-(4-chlorophenyl)-2-[5-(isopropylthio)-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-6,7-dimethoxy-3-methyl-isoquinolin-2-ium
BIS-[3-[6,7-DIMETHOXY-3-METHYL-1-(4-CHLOROPHENYL)-ISOQUINOLINIUM-2-YL]-1,2,4-TRIAZOLE-5-YLTHIO]-METHANE-DIBROMIDE
PJHBDIYFZOWVJF-UHFFFAOYSA-N
QWTURWLWKJLVMQ-UHFFFAOYSA-N
GIEXOKUTLCGJCO-UHFFFAOYSA-N
PYVLKZNVFRBBHF-UHFFFAOYSA-N
| Title | Journal or Book | Year |
|---|---|---|
| On triazoles XLIII. Synthesis of 1,2,4-triazolyl isoquinolinium zwitter ions | Journal of Heterocyclic Chemistry | 2001 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
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