Type | Program | Version | Descriptor |
SMILES | ACDLabs | 11.02 | O=C2Oc1cc(c(cc1C(O)=C2Cc4c3ccccc3ccc4)C)C |
SMILES_CANONICAL | CACTVS | 3.352 | Cc1cc2OC(=O)C(=C(O)c2cc1C)Cc3cccc4ccccc34 |
SMILES | CACTVS | 3.352 | Cc1cc2OC(=O)C(=C(O)c2cc1C)Cc3cccc4ccccc34 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1cc2c(cc1C)OC(=O)C(=C2O)Cc3cccc4c3cccc4 |
SMILES | OpenEye OEToolkits | 1.7.0 | Cc1cc2c(cc1C)OC(=O)C(=C2O)Cc3cccc4c3cccc4 |
InChI | InChI | 1.03 | InChI=1S/C22H18O3/c1-13-10-18-20(11-14(13)2)25-22(24)19(21(18)23)12-16-8-5-7-15-6-3-4-9-17(15)16/h3-11,23H,12H2,1-2H3 |
InChIKey | InChI | 1.03 | CLIXIKBUGAHFJT-UHFFFAOYSA-N |