NNJ
Summary
| Name: | 3-(aminomethyl)-1-methylpyridinium |
| Formula: | C7 H11 N2 |
| Formal charge: | 1 |
| Formula weight: | 123.176 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-(aminomethyl)-1-methylpyridinium |
| OpenEye OEToolkits | 1.7.0 | (1-methylpyridin-1-ium-3-yl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NCc1ccc[n+](c1)C |
| SMILES_CANONICAL | CACTVS | 3.370 | C[n+]1cccc(CN)c1 |
| SMILES | CACTVS | 3.370 | C[n+]1cccc(CN)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C[n+]1cccc(c1)CN |
| SMILES | OpenEye OEToolkits | 1.7.0 | C[n+]1cccc(c1)CN |
| InChI | InChI | 1.03 | InChI=1S/C7H11N2/c1-9-4-2-3-7(5-8)6-9/h2-4,6H,5,8H2,1H3/q+1 |
| InChIKey | InChI | 1.03 | MNWIURYABWVSGR-UHFFFAOYSA-N |
