Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Oc1ccc(cc1C(=O)O)S(=O)(=O)Nc1ccc(CCCC)cc1 |
InChI | InChI | 1.03 | InChI=1S/C17H19NO5S/c1-2-3-4-12-5-7-13(8-6-12)18-24(22,23)14-9-10-16(19)15(11-14)17(20)21/h5-11,18-19H,2-4H2,1H3,(H,20,21) |
InChIKey | InChI | 1.03 | AJISVEXLPBAKLT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCc1ccc(N[S](=O)(=O)c2ccc(O)c(c2)C(O)=O)cc1 |
SMILES | CACTVS | 3.385 | CCCCc1ccc(N[S](=O)(=O)c2ccc(O)c(c2)C(O)=O)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCc1ccc(cc1)NS(=O)(=O)c2ccc(c(c2)C(=O)O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCc1ccc(cc1)NS(=O)(=O)c2ccc(c(c2)C(=O)O)O |