| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CN(C(=O)Cn1c2N=C(NC(=O)c2nc1)N)CC[NH3+] |
| SMILES_CANONICAL | CACTVS | 3.370 | NC1=Nc2n(CC(=O)N(CC[NH3+])CC(O)=O)cnc2C(=O)N1 |
| SMILES | CACTVS | 3.370 | NC1=Nc2n(CC(=O)N(CC[NH3+])CC(O)=O)cnc2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1nc2c(n1CC(=O)N(CC[NH3+])CC(=O)O)N=C(NC2=O)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1nc2c(n1CC(=O)N(CC[NH3+])CC(=O)O)N=C(NC2=O)N |
| InChI | InChI | 1.03 | InChI=1S/C11H15N7O4/c12-1-2-17(4-7(20)21)6(19)3-18-5-14-8-9(18)15-11(13)16-10(8)22/h5H,1-4,12H2,(H,20,21)(H3,13,15,16,22)/p+1 |
| InChIKey | InChI | 1.03 | WYRWRGIGYVLOGE-UHFFFAOYSA-O |
