FM5
Summary
| Name: | 3-(N-HYDROXYACETAMIDO)-1-(3,4-DICHLOROPHENYL)PROPYLPHOSPHONIC ACID |
| Formula: | C11 H14 Cl2 N O5 P |
| Formal charge: | 0 |
| Formula weight: | 342.112 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | [(1S)-1-(3,4-dichlorophenyl)-3-(ethanoyl-hydroxy-amino)propyl]phosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | CC(=O)N(O)CC[C@@H](c1ccc(Cl)c(Cl)c1)[P](O)(O)=O |
| SMILES | CACTVS | 3.352 | CC(=O)N(O)CC[CH](c1ccc(Cl)c(Cl)c1)[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | CC(=O)N(CC[C@@H](c1ccc(c(c1)Cl)Cl)P(=O)(O)O)O |
| SMILES | OpenEye OEToolkits | 1.6.1 | CC(=O)N(CCC(c1ccc(c(c1)Cl)Cl)P(=O)(O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C11H14Cl2NO5P/c1-7(15)14(16)5-4-11(20(17,18)19)8-2-3-9(12)10(13)6-8/h2-3,6,11,16H,4-5H2,1H3,(H2,17,18,19)/t11-/m0/s1 |
| InChIKey | InChI | 1.03 | ABGCTQYLJZGMBM-NSHDSACASA-N |
