Type | Program | Version | Descriptor |
SMILES | ACDLabs | 11.02 | Clc1cccc(Cl)c1C(=O)NCc2ccc3OCOc3c2 |
SMILES_CANONICAL | CACTVS | 3.352 | Clc1cccc(Cl)c1C(=O)NCc2ccc3OCOc3c2 |
SMILES | CACTVS | 3.352 | Clc1cccc(Cl)c1C(=O)NCc2ccc3OCOc3c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(c(c(c1)Cl)C(=O)NCc2ccc3c(c2)OCO3)Cl |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(c(c(c1)Cl)C(=O)NCc2ccc3c(c2)OCO3)Cl |
InChI | InChI | 1.03 | InChI=1S/C15H11Cl2NO3/c16-10-2-1-3-11(17)14(10)15(19)18-7-9-4-5-12-13(6-9)21-8-20-12/h1-6H,7-8H2,(H,18,19) |
InChIKey | InChI | 1.03 | NMKJFZCBCIUYHI-UHFFFAOYSA-N |