Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C18H38NO6P/c1-6-7-8-9-10-11-12-13-18(20)25-17(2)16-24-26(21,22)23-15-14-19(3,4)5/h17H,6-16H2,1-5H3/p+1/t17-/m0/s1 |
InChIKey | InChI | 1.03 | QDKXDMCUNRVOEC-KRWDZBQOSA-O |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCC(=O)O[C@@H](C)CO[P](O)(=O)OCC[N+](C)(C)C |
SMILES | CACTVS | 3.385 | CCCCCCCCCC(=O)O[CH](C)CO[P](O)(=O)OCC[N+](C)(C)C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCC(=O)O[C@@H](C)COP(=O)(O)OCC[N+](C)(C)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCC(=O)OC(C)COP(=O)(O)OCC[N+](C)(C)C |