| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c1cc(c(cc1)N2C(=O)CCC2(CO)CO)NC(=[N@H])N |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=N)Nc1cc(ccc1N2C(=O)CCC2(CO)CO)C(O)=O |
| SMILES | CACTVS | 3.341 | NC(=N)Nc1cc(ccc1N2C(=O)CCC2(CO)CO)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1C(=O)O)NC(=N)N)N2C(=O)CCC2(CO)CO |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1C(=O)O)NC(=N)N)N2C(=O)CCC2(CO)CO |
| InChI | InChI | 1.03 | InChI=1S/C14H18N4O5/c15-13(16)17-9-5-8(12(22)23)1-2-10(9)18-11(21)3-4-14(18,6-19)7-20/h1-2,5,19-20H,3-4,6-7H2,(H,22,23)(H4,15,16,17) |
| InChIKey | InChI | 1.03 | IRNYFKBSAARAHR-UHFFFAOYSA-N |
