A1AJ2
Summary
| Name: | N-methylisoquinolin-1-amine |
| Formula: | C10 H10 N2 |
| Formal charge: | 0 |
| Formula weight: | 158.2 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methylisoquinolin-1-amine |
| OpenEye OEToolkits | 2.0.7 | ~{N}-methylisoquinolin-1-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CNc1nccc2ccccc21 |
| InChI | InChI | 1.06 | InChI=1S/C10H10N2/c1-11-10-9-5-3-2-4-8(9)6-7-12-10/h2-7H,1H3,(H,11,12) |
| InChIKey | InChI | 1.06 | BILUZSWZYDFPMN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNc1nccc2ccccc12 |
| SMILES | CACTVS | 3.385 | CNc1nccc2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNc1c2ccccc2ccn1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CNc1c2ccccc2ccn1 |
