Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | [O-]P(=O)(OCC[N+](C)(C)C)OCCCc1ccccc1 |
InChI | InChI | 1.03 | InChI=1S/C14H24NO4P/c1-15(2,3)11-13-19-20(16,17)18-12-7-10-14-8-5-4-6-9-14/h4-6,8-9H,7,10-13H2,1-3H3 |
InChIKey | InChI | 1.03 | NFUBQNQOSNBRKK-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[N+](C)(C)CCO[P]([O-])(=O)OCCCc1ccccc1 |
SMILES | CACTVS | 3.385 | C[N+](C)(C)CCO[P]([O-])(=O)OCCCc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C[N+](C)(C)CCOP(=O)([O-])OCCCc1ccccc1 |
SMILES | OpenEye OEToolkits | 1.9.2 | C[N+](C)(C)CCOP(=O)([O-])OCCCc1ccccc1 |