Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C2C(\c1ccccc1N2)=C\c3c(OC)cc(OC)cc3OC |
SMILES_CANONICAL | CACTVS | 3.341 | COc1cc(OC)c(/C=C2/C(=O)Nc3ccccc23)c(OC)c1 |
SMILES | CACTVS | 3.341 | COc1cc(OC)c(C=C2C(=O)Nc3ccccc23)c(OC)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COc1cc(c(c(c1)OC)\C=C\2/c3ccccc3NC2=O)OC |
SMILES | OpenEye OEToolkits | 1.5.0 | COc1cc(c(c(c1)OC)C=C2c3ccccc3NC2=O)OC |
InChI | InChI | 1.03 | InChI=1S/C18H17NO4/c1-21-11-8-16(22-2)14(17(9-11)23-3)10-13-12-6-4-5-7-15(12)19-18(13)20/h4-10H,1-3H3,(H,19,20)/b13-10+ |
InChIKey | InChI | 1.03 | JBJYTZXCZDNOJW-JLHYYAGUSA-N |