(2r)-2-[7-hydroxy-6-methoxy-1-[2-[4-(trifluoromethyl)phenyl]ethyl]isoquinolin-2-ium-2-yl]-n-methyl-2-phenylacetamide (CHEM343718)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 11:39:10 UTC | ||||||||
| Update Date | 2026-08-31 11:39:10 UTC | ||||||||
| Accession Number | CHEM343718 | ||||||||
| Identification | |||||||||
| Common Name | (2r)-2-[7-hydroxy-6-methoxy-1-[2-[4-(trifluoromethyl)phenyl]ethyl]isoquinolin-2-ium-2-yl]-n-methyl-2-phenylacetamide | ||||||||
| Class | Small Molecule | ||||||||
| Description | (2r)-2-[7-hydroxy-6-methoxy-1-[2-[4-(trifluoromethyl)phenyl]ethyl]isoquinolin-2-ium-2-yl]-n-methyl-2-phenylacetamide is a compound with the formula C28H26F3N2O3+. It has an average molecular weight of 495.50 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C28H26F3N2O3+ | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 495.190 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | (2r)-2-[7-hydroxy-6-methoxy-1-[2-[4-(trifluoromethyl)phenyl]ethyl]isoquinolin-2-ium-2-yl]-n-methyl-2-phenylacetamide | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CNC(=O)C(C1=CC=CC=C1)[N+]2=C(C3=CC(=C(C=C3C=C2)OC)O)CCC4=CC=C(C=C4)C(F)(F)F | ||||||||
| InChI Identifier | InChI=1S/C28H25F3N2O3/c1-32-27(35)26(19-6-4-3-5-7-19)33-15-14-20-16-25(36-2)24(34)17-22(20)23(33)13-10-18-8-11-21(12-9-18)28(29,30)31/h3-9,11-12,14-17,26H,10,13H2,1-2H3,(H-,32,34,35)/p+1/t26-/m1/s1 | ||||||||
| InChI Key | PJRKWSWZVRTUDQ-AREMUKBSSA-O | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
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| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
