1. Primary Information
| English name: | Granisetron hydrochloride |
| CAS No.: | 107007-99-8 |
| Molecular formula: | C18H25ClN4O |
| Molecular weight: | 348.9 g/mol |
| SMILES: | CN1C2CCCC1CC(C2)NC(=O)C3=NN(C4=CC=CC=C43)C.Cl |
| Structural class: | |
| Other identifiers: |
1-Methyl-N-(endo-9-Methyl-9-Azabicyclo(3.3.1)non-3-yl)-1H-Indazole-3-Carboxamide 1H-Indazole-3-carboxamide, 1-methyl-N-(9-methyl-9-azabicyclo(3.3.1)non-3-yl 1H-Indazole-3-carboxamide, 1-methyl-N-(9-methyl-9-azabicyclo(3.3.1)non-3-yl)-, endo- BRL 43694 BRL 43694A |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 100mg | HPLC≥98% | 240 | 2-8℃ | in stock | - |
| Kehua Intelligence | 250mg | 98% | 96 | 2-8℃ | in stock | - |
| Kehua Intelligence | 1g | 98% | 256 | 2-8℃ | in stock | - |
| Kehua Intelligence | 5g | 98% | 784 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
1-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)indazole-3-carboxamide;hydrochloride
4.2 InChI
InChI=1S/C18H24N4O.ClH/c1-21-13-6-5-7-14(21)11-12(10-13)19-18(23)17-15-8-3-4-9-16(15)22(2)20-17;/h3-4,8-9,12-14H,5-7,10-11H2,1-2H3,(H,19,23);1H
4.3 InChIKey
QYZRTBKYBJRGJB-UHFFFAOYSA-N
4.4 Canonical SMILES
CN1C2CCCC1CC(C2)NC(=O)C3=NN(C4=CC=CC=C43)C.Cl
4.5 Isomeric SMILES
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