RIQ
Summary
| Name: | 1-[4,5-bis(chloranyl)-2,3-dihydroindol-1-yl]ethanone |
| Formula: | C10 H9 Cl2 N O |
| Formal charge: | 0 |
| Formula weight: | 230.091 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 1-[4,5-bis(chloranyl)-2,3-dihydroindol-1-yl]ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H9Cl2NO/c1-6(14)13-5-4-7-9(13)3-2-8(11)10(7)12/h2-3H,4-5H2,1H3 |
| InChIKey | InChI | 1.06 | FSLARAPYXMNEFP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1CCc2c(Cl)c(Cl)ccc12 |
| SMILES | CACTVS | 3.385 | CC(=O)N1CCc2c(Cl)c(Cl)ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC(=O)N1CCc2c1ccc(c2Cl)Cl |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(=O)N1CCc2c1ccc(c2Cl)Cl |
