| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(N)C4=C(O)C3=C(O)c2c(O)c1c(O)cccc1cc2CC3C(N(C)C)C4=O |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(C)[C@H]1[C@@H]2Cc3cc4cccc(O)c4c(O)c3C(=C2C(=C(C(N)=O)C1=O)O)O |
| SMILES | CACTVS | 3.341 | CN(C)[CH]1[CH]2Cc3cc4cccc(O)c4c(O)c3C(=C2C(=C(C(N)=O)C1=O)O)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(C)[C@H]1[C@@H]2Cc3cc4cccc(c4c(c3C(=C2C(=C(C1=O)C(=O)N)O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN(C)C1C2Cc3cc4cccc(c4c(c3C(=C2C(=C(C1=O)C(=O)N)O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C21H20N2O6/c1-23(2)16-10-7-9-6-8-4-3-5-11(24)12(8)17(25)13(9)18(26)14(10)19(27)15(20(16)28)21(22)29/h3-6,10,16,24-27H,7H2,1-2H3,(H2,22,29)/t10-,16+/m1/s1 |
| InChIKey | InChI | 1.03 | CSMTWDGQMUIMDU-HWPZZCPQSA-N |
