Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=[N+]([O-])c1cc(c(cc1Cl)NCc2cc(F)c(F)c(F)c2)C(=O)N |
SMILES_CANONICAL | CACTVS | 3.370 | NC(=O)c1cc(c(Cl)cc1NCc2cc(F)c(F)c(F)c2)[N+]([O-])=O |
SMILES | CACTVS | 3.370 | NC(=O)c1cc(c(Cl)cc1NCc2cc(F)c(F)c(F)c2)[N+]([O-])=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1c(cc(c(c1F)F)F)CNc2cc(c(cc2C(=O)N)[N+](=O)[O-])Cl |
SMILES | OpenEye OEToolkits | 1.7.0 | c1c(cc(c(c1F)F)F)CNc2cc(c(cc2C(=O)N)[N+](=O)[O-])Cl |
InChI | InChI | 1.03 | InChI=1S/C14H9ClF3N3O3/c15-8-4-11(7(14(19)22)3-12(8)21(23)24)20-5-6-1-9(16)13(18)10(17)2-6/h1-4,20H,5H2,(H2,19,22) |
InChIKey | InChI | 1.03 | NORJUSOCNUXTJH-UHFFFAOYSA-N |