| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | COc1ccc(cc1)C(=O)Nc1ccc2c(c1)C(C)c1ccccc1C(=O)N2CC#CC |
| InChI | InChI | 1.06 | InChI=1S/C27H24N2O3/c1-4-5-16-29-25-15-12-20(28-26(30)19-10-13-21(32-3)14-11-19)17-24(25)18(2)22-8-6-7-9-23(22)27(29)31/h6-15,17-18H,16H2,1-3H3,(H,28,30)/t18-/m0/s1 |
| InChIKey | InChI | 1.06 | UOPYPQPUAYFZKT-SFHVURJKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)C(=O)Nc2ccc3N(CC#CC)C(=O)c4ccccc4[C@H](C)c3c2 |
| SMILES | CACTVS | 3.385 | COc1ccc(cc1)C(=O)Nc2ccc3N(CC#CC)C(=O)c4ccccc4[CH](C)c3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC#CCN1c2ccc(cc2[C@H](c3ccccc3C1=O)C)NC(=O)c4ccc(cc4)OC |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC#CCN1c2ccc(cc2C(c3ccccc3C1=O)C)NC(=O)c4ccc(cc4)OC |
