Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc1cc(c(Cl)cc1)S(=O)(=O)Nc2nc3cc(Cl)ccc3o2 |
SMILES_CANONICAL | CACTVS | 3.341 | Clc1ccc2oc(N[S](=O)(=O)c3cc(Cl)ccc3Cl)nc2c1 |
SMILES | CACTVS | 3.341 | Clc1ccc2oc(N[S](=O)(=O)c3cc(Cl)ccc3Cl)nc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1Cl)nc(o2)NS(=O)(=O)c3cc(ccc3Cl)Cl |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1Cl)nc(o2)NS(=O)(=O)c3cc(ccc3Cl)Cl |
InChI | InChI | 1.03 | InChI=1S/C13H7Cl3N2O3S/c14-7-2-4-11-10(5-7)17-13(21-11)18-22(19,20)12-6-8(15)1-3-9(12)16/h1-6H,(H,17,18) |
InChIKey | InChI | 1.03 | JCXZHFCBNFFHRC-UHFFFAOYSA-N |