| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | COc1cccc(c1)NC(=O)NCc1cccc(c1)c1nn2C(=O)C=C(Nc2c1CC)c1cccc(c1)C(=O)O |
| InChI | InChI | 1.06 | InChI=1S/C30H27N5O5/c1-3-24-27(34-35-26(36)16-25(33-28(24)35)19-8-5-10-21(14-19)29(37)38)20-9-4-7-18(13-20)17-31-30(39)32-22-11-6-12-23(15-22)40-2/h4-16,33H,3,17H2,1-2H3,(H,37,38)(H2,31,32,39) |
| InChIKey | InChI | 1.06 | HFZZJWSATOFNRA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCc1c2NC(=CC(=O)n2nc1c3cccc(CNC(=O)Nc4cccc(OC)c4)c3)c5cccc(c5)C(O)=O |
| SMILES | CACTVS | 3.385 | CCc1c2NC(=CC(=O)n2nc1c3cccc(CNC(=O)Nc4cccc(OC)c4)c3)c5cccc(c5)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CCc1c(nn2c1NC(=CC2=O)c3cccc(c3)C(=O)O)c4cccc(c4)CNC(=O)Nc5cccc(c5)OC |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CCc1c(nn2c1NC(=CC2=O)c3cccc(c3)C(=O)O)c4cccc(c4)CNC(=O)Nc5cccc(c5)OC |
