G8V
Summary
| Name: | 1-benzyl-4-(dimethylamino)pyridinium |
| Formula: | C14 H17 N2 |
| Formal charge: | 1 |
| Formula weight: | 213.298 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-benzyl-4-(dimethylamino)pyridinium |
| OpenEye OEToolkits | 1.7.6 | N,N-dimethyl-1-(phenylmethyl)pyridin-1-ium-4-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(c1cc[n+](cc1)Cc2ccccc2)(C)C |
| InChI | InChI | 1.03 | InChI=1S/C14H17N2/c1-15(2)14-8-10-16(11-9-14)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3/q+1 |
| InChIKey | InChI | 1.03 | WFCLXYFMXYSPQT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)c1cc[n+](Cc2ccccc2)cc1 |
| SMILES | CACTVS | 3.385 | CN(C)c1cc[n+](Cc2ccccc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN(C)c1cc[n+](cc1)Cc2ccccc2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CN(C)c1cc[n+](cc1)Cc2ccccc2 |
