ISQ
Summary
| Name: | ISOQUINOLINE |
| Formula: | C9 H7 N |
| Formal charge: | 0 |
| Formula weight: | 129.159 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | isoquinoline |
| OpenEye OEToolkits | 1.5.0 | isoquinoline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2ccc1c(cccc1)c2 |
| SMILES_CANONICAL | CACTVS | 3.341 | c1ccc2cnccc2c1 |
| SMILES | CACTVS | 3.341 | c1ccc2cnccc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2cnccc2c1 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2cnccc2c1 |
| InChI | InChI | 1.03 | InChI=1S/C9H7N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-7H |
| InChIKey | InChI | 1.03 | AWJUIBRHMBBTKR-UHFFFAOYSA-N |
