| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(N(C1CC1)Cc2cc(ccc2Cl)CCCOC)C5C(c4ccc(OCCOc3c(Cl)cc(cc3Cl)C)cc4)CCNC5 |
| SMILES_CANONICAL | CACTVS | 3.370 | COCCCc1ccc(Cl)c(CN(C2CC2)C(=O)[C@H]3CNCC[C@@H]3c4ccc(OCCOc5c(Cl)cc(C)cc5Cl)cc4)c1 |
| SMILES | CACTVS | 3.370 | COCCCc1ccc(Cl)c(CN(C2CC2)C(=O)[CH]3CNCC[CH]3c4ccc(OCCOc5c(Cl)cc(C)cc5Cl)cc4)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1cc(c(c(c1)Cl)OCCOc2ccc(cc2)[C@H]3CCNC[C@@H]3C(=O)N(Cc4cc(ccc4Cl)CCCOC)C5CC5)Cl |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1cc(c(c(c1)Cl)OCCOc2ccc(cc2)C3CCNCC3C(=O)N(Cc4cc(ccc4Cl)CCCOC)C5CC5)Cl |
| InChI | InChI | 1.03 | InChI=1S/C35H41Cl3N2O4/c1-23-18-32(37)34(33(38)19-23)44-17-16-43-28-10-6-25(7-11-28)29-13-14-39-21-30(29)35(41)40(27-8-9-27)22-26-20-24(4-3-15-42-2)5-12-31(26)36/h5-7,10-12,18-20,27,29-30,39H,3-4,8-9,13-17,21-22H2,1-2H3/t29-,30+/m1/s1 |
| InChIKey | InChI | 1.03 | RDCUZWVELSAOBC-IHLOFXLRSA-N |
