| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C29H28N2O5/c1-20(32)30-17-25(14-22-15-26(34-2)28-27(16-22)35-19-36-28)31(29(33)23-11-7-4-8-12-23)18-24(30)13-21-9-5-3-6-10-21/h3-12,14-16,24H,13,17-19H2,1-2H3/b25-14-/t24-/m0/s1 |
| InChIKey | InChI | 1.06 | NOOJBZHDPURBGQ-RBNJWJBESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(\C=C2\CN([C@H](CN2C(=O)c3ccccc3)Cc4ccccc4)C(C)=O)cc5OCOc15 |
| SMILES | CACTVS | 3.385 | COc1cc(C=C2CN([CH](CN2C(=O)c3ccccc3)Cc4ccccc4)C(C)=O)cc5OCOc15 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N1C/C(=C/c2cc3c(c(c2)OC)OCO3)/N(C[C@@H]1Cc4ccccc4)C(=O)c5ccccc5 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CC(=Cc2cc3c(c(c2)OC)OCO3)N(CC1Cc4ccccc4)C(=O)c5ccccc5 |
