Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=P(O)(O)OP(=O)(OCC(\F)=C(/C)CC\C=C(/C)C)O |
InChI | InChI | 1.03 | InChI=1S/C10H19FO7P2/c1-8(2)5-4-6-9(3)10(11)7-17-20(15,16)18-19(12,13)14/h5H,4,6-7H2,1-3H3,(H,15,16)(H2,12,13,14)/b10-9- |
InChIKey | InChI | 1.03 | BYJNSLXDWGDGAC-KTKRTIGZSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CC(C)=CCCC(/C)=C(F)/CO[P](O)(=O)O[P](O)(O)=O |
SMILES | CACTVS | 3.370 | CC(C)=CCCC(C)=C(F)CO[P](O)(=O)O[P](O)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=CCC/C(=C(/COP(=O)(O)OP(=O)(O)O)\F)/C)C |
SMILES | OpenEye OEToolkits | 1.7.6 | CC(=CCCC(=C(COP(=O)(O)OP(=O)(O)O)F)C)C |