Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(O)OCC(O)C(O)Nc1ccccc1O |
SMILES_CANONICAL | CACTVS | 3.341 | O[C@H](CO[P](O)(O)=O)[C@@H](O)Nc1ccccc1O |
SMILES | CACTVS | 3.341 | O[CH](CO[P](O)(O)=O)[CH](O)Nc1ccccc1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)N[C@@H]([C@@H](COP(=O)(O)O)O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)NC(C(COP(=O)(O)O)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C9H14NO7P/c11-7-4-2-1-3-6(7)10-9(13)8(12)5-17-18(14,15)16/h1-4,8-13H,5H2,(H2,14,15,16)/t8-,9-/m1/s1 |
InChIKey | InChI | 1.03 | SPOVITMZOKMJPQ-RKDXNWHRSA-N |