YCS
Summary
| Name: | (2~{R})-2-(4-bromanylphenoxy)propanamide |
| Formula: | C9 H10 Br N O2 |
| Formal charge: | 0 |
| Formula weight: | 244.085 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-2-(4-bromanylphenoxy)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H10BrNO2/c1-6(9(11)12)13-8-4-2-7(10)3-5-8/h2-6H,1H3,(H2,11,12)/t6-/m1/s1 |
| InChIKey | InChI | 1.03 | GBEDJWZQBGSKBM-ZCFIWIBFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](Oc1ccc(Br)cc1)C(N)=O |
| SMILES | CACTVS | 3.385 | C[CH](Oc1ccc(Br)cc1)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H](C(=O)N)Oc1ccc(cc1)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C(=O)N)Oc1ccc(cc1)Br |
