OQE
Summary
| Name: | [2-[2-oxidanylidene-2-(2-phenylethylamino)ethoxy]phenyl]phosphonic acid |
| Formula: | C16 H18 N O5 P |
| Formal charge: | 0 |
| Formula weight: | 335.292 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [2-[2-oxidanylidene-2-(2-phenylethylamino)ethoxy]phenyl]phosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H18NO5P/c18-16(17-11-10-13-6-2-1-3-7-13)12-22-14-8-4-5-9-15(14)23(19,20)21/h1-9H,10-12H2,(H,17,18)(H2,19,20,21) |
| InChIKey | InChI | 1.03 | FRNXSTXSXYWTDK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[P](O)(=O)c1ccccc1OCC(=O)NCCc2ccccc2 |
| SMILES | CACTVS | 3.385 | O[P](O)(=O)c1ccccc1OCC(=O)NCCc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CCNC(=O)COc2ccccc2P(=O)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CCNC(=O)COc2ccccc2P(=O)(O)O |
