| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C2c1n(c(c(c1C(=O)C(=C2)N3CC3)CO)CCCO)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cn1c(CCCO)c(CO)c2C(=O)C(=CC(=O)c12)N3CC3 |
| SMILES | CACTVS | 3.341 | Cn1c(CCCO)c(CO)c2C(=O)C(=CC(=O)c12)N3CC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cn1c(c(c2c1C(=O)C=C(C2=O)N3CC3)CO)CCCO |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cn1c(c(c2c1C(=O)C=C(C2=O)N3CC3)CO)CCCO |
| InChI | InChI | 1.03 | InChI=1S/C15H18N2O4/c1-16-10(3-2-6-18)9(8-19)13-14(16)12(20)7-11(15(13)21)17-4-5-17/h7,18-19H,2-6,8H2,1H3 |
| InChIKey | InChI | 1.03 | JCCDRCRHGKFTQS-UHFFFAOYSA-N |
