A1I78
Summary
| Name: | 5-chloranyl-~{N}-(2-phenylethyl)pyridin-2-amine |
| Formula: | C13 H13 Cl N2 |
| Formal charge: | 0 |
| Formula weight: | 232.709 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-chloranyl-~{N}-(2-phenylethyl)pyridin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H13ClN2/c14-12-6-7-13(16-10-12)15-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,15,16) |
| InChIKey | InChI | 1.06 | OJJOGNKRRKJWCJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(NCCc2ccccc2)nc1 |
| SMILES | CACTVS | 3.385 | Clc1ccc(NCCc2ccccc2)nc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CCNc2ccc(cn2)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CCNc2ccc(cn2)Cl |
