0WQ
Summary
| Name: | Z-2-(3-bromophenyl) propanal oxime |
| Formula: | C9 H10 Br N O |
| Formal charge: | 0 |
| Formula weight: | 228.086 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (~{N}~{Z})-~{N}-[(2~{R})-2-(3-bromophenyl)propylidene]hydroxylamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H10BrNO/c1-7(6-11-12)8-3-2-4-9(10)5-8/h2-7,12H,1H3/b11-6-/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | SPBCOZIJYSLWMT-KSRYWAHESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](\C=N/O)c1cccc(Br)c1 |
| SMILES | CACTVS | 3.385 | C[CH](C=NO)c1cccc(Br)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H](/C=N\O)c1cccc(c1)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C=NO)c1cccc(c1)Br |
