| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Cc1ccc(NC(=O)Nc2ccccc2C)cc1)N1CCOCC1C(=O)N1CCC(CC(=O)O)CC1 |
| InChI | InChI | 1.06 | InChI=1S/C28H34N4O6/c1-19-4-2-3-5-23(19)30-28(37)29-22-8-6-20(7-9-22)16-25(33)32-14-15-38-18-24(32)27(36)31-12-10-21(11-13-31)17-26(34)35/h2-9,21,24H,10-18H2,1H3,(H,34,35)(H2,29,30,37)/t24-/m0/s1 |
| InChIKey | InChI | 1.06 | ITXAAOWFOURIHK-DEOSSOPVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccccc1NC(=O)Nc2ccc(CC(=O)N3CCOC[C@H]3C(=O)N4CCC(CC4)CC(O)=O)cc2 |
| SMILES | CACTVS | 3.385 | Cc1ccccc1NC(=O)Nc2ccc(CC(=O)N3CCOC[CH]3C(=O)N4CCC(CC4)CC(O)=O)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1ccccc1NC(=O)Nc2ccc(cc2)CC(=O)N3CCOC[C@H]3C(=O)N4CCC(CC4)CC(=O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1ccccc1NC(=O)Nc2ccc(cc2)CC(=O)N3CCOCC3C(=O)N4CCC(CC4)CC(=O)O |
