WLX
Summary
| Name: | isoquinolin-3-amine |
| Formula: | C9 H8 N2 |
| Formal charge: | 0 |
| Formula weight: | 144.173 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | isoquinolin-3-amine |
| OpenEye OEToolkits | 2.0.7 | isoquinolin-3-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Nc1cc2ccccc2cn1 |
| InChI | InChI | 1.06 | InChI=1S/C9H8N2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-6H,(H2,10,11) |
| InChIKey | InChI | 1.06 | VYCKDIRCVDCQAE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cc2ccccc2cn1 |
| SMILES | CACTVS | 3.385 | Nc1cc2ccccc2cn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2cnc(cc2c1)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2cnc(cc2c1)N |
