3QO
Summary
| Name: | 4-benzylpyridine |
| Formula: | C12 H11 N |
| Formal charge: | 0 |
| Formula weight: | 169.222 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-benzylpyridine |
| OpenEye OEToolkits | 1.7.0 | 4-(phenylmethyl)pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1ccc(cc1)Cc2ccccc2 |
| SMILES_CANONICAL | CACTVS | 3.370 | C(c1ccccc1)c2ccncc2 |
| SMILES | CACTVS | 3.370 | C(c1ccccc1)c2ccncc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)Cc2ccncc2 |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)Cc2ccncc2 |
| InChI | InChI | 1.03 | InChI=1S/C12H11N/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-9H,10H2 |
| InChIKey | InChI | 1.03 | DBOLXXRVIFGDTI-UHFFFAOYSA-N |
