Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc2ccc(OCC(=O)Nc1ccccc1C(=O)O)cc2 |
SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)c1ccccc1NC(=O)COc2ccc(Cl)cc2 |
SMILES | CACTVS | 3.341 | OC(=O)c1ccccc1NC(=O)COc2ccc(Cl)cc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)C(=O)O)NC(=O)COc2ccc(cc2)Cl |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)C(=O)O)NC(=O)COc2ccc(cc2)Cl |
InChI | InChI | 1.03 | InChI=1S/C15H12ClNO4/c16-10-5-7-11(8-6-10)21-9-14(18)17-13-4-2-1-3-12(13)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20) |
InChIKey | InChI | 1.03 | LXSDGQYDSDIUPN-UHFFFAOYSA-N |