PJW
Summary
| Name: | benzo[b][1]benziodole |
| Formula: | C12 H8 I |
| Formal charge: | 0 |
| Formula weight: | 279.096 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | benzo[b][1]benziodole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H9I/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8,13H |
| InChIKey | InChI | 1.03 | PEWVMQDYYUSPRM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | [I]1c2ccccc2c3ccccc13 |
| SMILES | CACTVS | 3.385 | [I]1c2ccccc2c3ccccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)-c3ccccc3I2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)-c3ccccc3I2 |
