| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C20H26N2O4/c23-13-18(24)17-10-5-11-22(17)20(26)16-9-4-8-15(16)19(25)21-12-14-6-2-1-3-7-14/h1-3,6-8,16-18,23-24H,4-5,9-13H2,(H,21,25)/t16-,17+,18+/m1/s1 |
| InChIKey | InChI | 1.03 | YWYIBAJVRQWUCG-SQNIBIBYSA-N |
| SMILES | ACDLabs | 12.01 | O=C(N1C(C(O)CO)CCC1)C3C(C(=O)NCc2ccccc2)=CCC3 |
| SMILES_CANONICAL | CACTVS | 3.370 | OC[C@H](O)[C@@H]1CCCN1C(=O)[C@@H]2CCC=C2C(=O)NCc3ccccc3 |
| SMILES | CACTVS | 3.370 | OC[CH](O)[CH]1CCCN1C(=O)[CH]2CCC=C2C(=O)NCc3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CNC(=O)C2=CCC[C@H]2C(=O)N3CCC[C@H]3[C@H](CO)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CNC(=O)C2=CCCC2C(=O)N3CCCC3C(CO)O |
