Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1CN(c2c(N1)cccc2)C(=O)C(c3ccccc3)=[C@H]c4ccc(cc4)OC |
InChI | InChI | 1.03 | InChI=1S/C24H20N2O3/c1-29-19-13-11-17(12-14-19)15-20(18-7-3-2-4-8-18)24(28)26-16-23(27)25-21-9-5-6-10-22(21)26/h2-15H,16H2,1H3,(H,25,27)/b20-15+ |
InChIKey | InChI | 1.03 | WQITZMVRSQPEBE-HMMYKYKNSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)\C=C(\C(=O)N2CC(=O)Nc3ccccc23)c4ccccc4 |
SMILES | CACTVS | 3.385 | COc1ccc(cc1)C=C(C(=O)N2CC(=O)Nc3ccccc23)c4ccccc4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | COc1ccc(cc1)/C=C(\c2ccccc2)/C(=O)N3CC(=O)Nc4c3cccc4 |
SMILES | OpenEye OEToolkits | 1.9.2 | COc1ccc(cc1)C=C(c2ccccc2)C(=O)N3CC(=O)Nc4c3cccc4 |