B1J
Summary
| Name: | [1-(4-chlorophenyl)-1,2,3-triazol-4-yl]methanol |
| Formula: | C9 H8 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 209.632 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [1-(4-chlorophenyl)-1,2,3-triazol-4-yl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H8ClN3O/c10-7-1-3-9(4-2-7)13-5-8(6-14)11-12-13/h1-5,14H,6H2 |
| InChIKey | InChI | 1.03 | CAHIFLPAMJOAGI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCc1cn(nn1)c2ccc(Cl)cc2 |
| SMILES | CACTVS | 3.385 | OCc1cn(nn1)c2ccc(Cl)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1n2cc(nn2)CO)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1n2cc(nn2)CO)Cl |
