A1L8E
Summary
| Name: | 14-[diphenyl(pyridin-2-yl)-$l^{5}-phosphanyl]tetradecyl 2-methyl-4-oxidanyl-benzoate |
| Formula: | C39 H50 N O3 P |
| Formal charge: | 0 |
| Formula weight: | 611.793 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 14-[diphenyl(pyridin-2-yl)-$l^{5}-phosphanyl]tetradecyl 2-methyl-4-oxidanyl-benzoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C39H50NO3P/c1-33-32-34(41)27-28-37(33)39(42)43-30-20-10-8-6-4-2-3-5-7-9-11-21-31-44(35-22-14-12-15-23-35,36-24-16-13-17-25-36)38-26-18-19-29-40-38/h12-19,22-29,32,41,44H,2-11,20-21,30-31H2,1H3 |
| InChIKey | InChI | 1.06 | XOLHROXNDQJWIB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(O)ccc1C(=O)OCCCCCCCCCCCCCC[PH](c2ccccc2)(c3ccccc3)c4ccccn4 |
| SMILES | CACTVS | 3.385 | Cc1cc(O)ccc1C(=O)OCCCCCCCCCCCCCC[PH](c2ccccc2)(c3ccccc3)c4ccccn4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1C(=O)OCCCCCCCCCCCCCCP(c2ccccc2)(c3ccccc3)c4ccccn4)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1C(=O)OCCCCCCCCCCCCCCP(c2ccccc2)(c3ccccc3)c4ccccn4)O |
