Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CNC(=O)c2nc1cc(Cl)c(Cl)cc1n2 |
SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)CNC(=O)c1[nH]c2cc(Cl)c(Cl)cc2n1 |
SMILES | CACTVS | 3.370 | OC(=O)CNC(=O)c1[nH]c2cc(Cl)c(Cl)cc2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1c2c(cc(c1Cl)Cl)nc([nH]2)C(=O)NCC(=O)O |
SMILES | OpenEye OEToolkits | 1.7.0 | c1c2c(cc(c1Cl)Cl)nc([nH]2)C(=O)NCC(=O)O |
InChI | InChI | 1.03 | InChI=1S/C10H7Cl2N3O3/c11-4-1-6-7(2-5(4)12)15-9(14-6)10(18)13-3-8(16)17/h1-2H,3H2,(H,13,18)(H,14,15)(H,16,17) |
InChIKey | InChI | 1.03 | ALMZPAHRESNZRJ-UHFFFAOYSA-N |