Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1cc(ccc1C(=O)NCc2c(cccc2F)F)S(N)(=O)=O |
InChI | InChI | 1.03 | InChI=1S/C14H12F2N2O3S/c15-12-2-1-3-13(16)11(12)8-18-14(19)9-4-6-10(7-5-9)22(17,20)21/h1-7H,8H2,(H,18,19)(H2,17,20,21) |
InChIKey | InChI | 1.03 | ZFNCKGXGCCDDFN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)C(=O)NCc2c(F)cccc2F |
SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)C(=O)NCc2c(F)cccc2F |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)F)CNC(=O)c2ccc(cc2)S(=O)(=O)N)F |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)F)CNC(=O)c2ccc(cc2)S(=O)(=O)N)F |