IPP
Summary
| Name: | (P-IODOPHENYLACETYLAMINO)METHYLPHOSPHINIC ACID |
| Formula: | C9 H11 I N O3 P |
| Formal charge: | 0 |
| Formula weight: | 339.067 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (R)-({[(4-iodophenyl)acetyl]amino}methyl)phosphinic acid |
| OpenEye OEToolkits | 1.5.0 | [2-(4-iodophenyl)ethanoylamino]methylphosphinic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Ic1ccc(cc1)CC(=O)NCP(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | O[P@@H](=O)CNC(=O)Cc1ccc(I)cc1 |
| SMILES | CACTVS | 3.341 | O[PH](=O)CNC(=O)Cc1ccc(I)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CC(=O)NC[P@H](=O)O)I |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CC(=O)NCP(=O)O)I |
| InChI | InChI | 1.03 | InChI=1S/C9H11INO3P/c10-8-3-1-7(2-4-8)5-9(12)11-6-15(13)14/h1-4,15H,5-6H2,(H,11,12)(H,13,14) |
| InChIKey | InChI | 1.03 | NJMHQBSYSLWOQF-UHFFFAOYSA-N |
