5IQ
Summary
| Name: | ISOQUINOLIN-5-AMINE |
| Synonyms: | 5-AMINOISOQUINOLINE |
| Formula: | C9 H8 N2 |
| Formal charge: | 0 |
| Formula weight: | 144.173 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | isoquinolin-5-amine |
| OpenEye OEToolkits | 1.5.0 | isoquinolin-5-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2ccc1c(cccc1N)c2 |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1cccc2cnccc12 |
| SMILES | CACTVS | 3.341 | Nc1cccc2cnccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2cnccc2c(c1)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2cnccc2c(c1)N |
| InChI | InChI | 1.03 | InChI=1S/C9H8N2/c10-9-3-1-2-7-6-11-5-4-8(7)9/h1-6H,10H2 |
| InChIKey | InChI | 1.03 | DTVYNUOOZIKEEX-UHFFFAOYSA-N |
