Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=P(O)(O)c2ccccc2OCC(=O)Nc1cccc(OC)c1 |
InChI | InChI | 1.03 | InChI=1S/C15H16NO6P/c1-21-12-6-4-5-11(9-12)16-15(17)10-22-13-7-2-3-8-14(13)23(18,19)20/h2-9H,10H2,1H3,(H,16,17)(H2,18,19,20) |
InChIKey | InChI | 1.03 | RAGQGGPMVFHHRB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | COc1cccc(NC(=O)COc2ccccc2[P](O)(O)=O)c1 |
SMILES | CACTVS | 3.370 | COc1cccc(NC(=O)COc2ccccc2[P](O)(O)=O)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | COc1cccc(c1)NC(=O)COc2ccccc2P(=O)(O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | COc1cccc(c1)NC(=O)COc2ccccc2P(=O)(O)O |