IDI
Summary
| Name: | 7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE |
| Formula: | C9 H10 I N |
| Formal charge: | 0 |
| Formula weight: | 259.087 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 7-iodo-1,2,3,4-tetrahydroisoquinoline |
| OpenEye OEToolkits | 1.5.0 | 7-iodo-1,2,3,4-tetrahydroisoquinoline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Ic1ccc2c(c1)CNCC2 |
| SMILES_CANONICAL | CACTVS | 3.341 | Ic1ccc2CCNCc2c1 |
| SMILES | CACTVS | 3.341 | Ic1ccc2CCNCc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1I)CNCC2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1I)CNCC2 |
| InChI | InChI | 1.03 | InChI=1S/C9H10IN/c10-9-2-1-7-3-4-11-6-8(7)5-9/h1-2,5,11H,3-4,6H2 |
| InChIKey | InChI | 1.03 | FFCFXJXBXUOFIU-UHFFFAOYSA-N |
