| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | N#Cc4cc(Oc3c(Cl)ccc(OCc2nnc1ccccc12)c3)cc(Cl)c4 |
| SMILES_CANONICAL | CACTVS | 3.341 | Clc1cc(Oc2cc(OCc3n[nH]c4ccccc34)ccc2Cl)cc(c1)C#N |
| SMILES | CACTVS | 3.341 | Clc1cc(Oc2cc(OCc3n[nH]c4ccccc34)ccc2Cl)cc(c1)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(n[nH]2)COc3ccc(c(c3)Oc4cc(cc(c4)Cl)C#N)Cl |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(n[nH]2)COc3ccc(c(c3)Oc4cc(cc(c4)Cl)C#N)Cl |
| InChI | InChI | 1.03 | InChI=1S/C21H13Cl2N3O2/c22-14-7-13(11-24)8-16(9-14)28-21-10-15(5-6-18(21)23)27-12-20-17-3-1-2-4-19(17)25-26-20/h1-10H,12H2,(H,25,26) |
| InChIKey | InChI | 1.03 | WHCLIFOVZDANCU-UHFFFAOYSA-N |
