F98
Summary
| Name: | 3-[ethanoyl(hydroxy)amino]propylphosphonic acid |
| Formula: | C5 H12 N O5 P |
| Formal charge: | 0 |
| Formula weight: | 197.126 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | {3-[acetyl(hydroxy)amino]propyl}phosphonic acid |
| OpenEye OEToolkits | 1.7.0 | 3-[ethanoyl(hydroxy)amino]propylphosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=P(O)(O)CCCN(O)C(=O)C |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(=O)N(O)CCC[P](O)(O)=O |
| SMILES | CACTVS | 3.370 | CC(=O)N(O)CCC[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC(=O)N(CCCP(=O)(O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC(=O)N(CCCP(=O)(O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H12NO5P/c1-5(7)6(8)3-2-4-12(9,10)11/h8H,2-4H2,1H3,(H2,9,10,11) |
| InChIKey | InChI | 1.03 | PKMNDDZSIHLLLI-UHFFFAOYSA-N |
