| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Clc1ccc(cc1)OCC(=O)NC1CCC(CC1)N(Cc1ccncc1)C(=O)CCOc1ccc(Cl)cc1 |
| InChI | InChI | 1.06 | InChI=1S/C29H31Cl2N3O4/c30-22-1-9-26(10-2-22)37-18-15-29(36)34(19-21-13-16-32-17-14-21)25-7-5-24(6-8-25)33-28(35)20-38-27-11-3-23(31)4-12-27/h1-4,9-14,16-17,24-25H,5-8,15,18-20H2,(H,33,35)/t24-,25- |
| InChIKey | InChI | 1.06 | ZSKCSXHRUVZRGU-SOAUALDESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(OCCC(=O)N(Cc2ccncc2)[C@H]3CC[C@@H](CC3)NC(=O)COc4ccc(Cl)cc4)cc1 |
| SMILES | CACTVS | 3.385 | Clc1ccc(OCCC(=O)N(Cc2ccncc2)[CH]3CC[CH](CC3)NC(=O)COc4ccc(Cl)cc4)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1OCCC(=O)N(Cc2ccncc2)C3CCC(CC3)NC(=O)COc4ccc(cc4)Cl)Cl |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1OCCC(=O)N(Cc2ccncc2)C3CCC(CC3)NC(=O)COc4ccc(cc4)Cl)Cl |
