KBR
Summary
| Name: | Icaridin |
| Synonyms: | Picaridin Bayrepel; KBR 3023 |
| Formula: | C12 H23 N O3 |
| Formal charge: | 0 |
| Formula weight: | 229.316 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | [(2~{R})-butan-2-yl] (2~{S})-2-(2-hydroxyethyl)piperidine-1-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/t10-,11+/m1/s1 |
| InChIKey | InChI | 1.03 | QLHULAHOXSSASE-MNOVXSKESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[C@@H](C)OC(=O)N1CCCC[C@H]1CCO |
| SMILES | CACTVS | 3.385 | CC[CH](C)OC(=O)N1CCCC[CH]1CCO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CC[C@@H](C)OC(=O)N1CCCC[C@H]1CCO |
| SMILES | OpenEye OEToolkits | 2.0.4 | CCC(C)OC(=O)N1CCCCC1CCO |
