QH7
Summary
Name: | 2,3,6-trifluoro-N-hydroxybenzamide |
Formula: | C7 H4 F3 N O2 |
Formal charge: | 0 |
Formula weight: | 191.107 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2,3,6-trifluoro-N-hydroxybenzamide |
OpenEye OEToolkits | 2.0.7 | 2,3,6-tris(fluoranyl)-~{N}-oxidanyl-benzamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Fc1c(C(=O)NO)c(F)ccc1F |
InChI | InChI | 1.03 | InChI=1S/C7H4F3NO2/c8-3-1-2-4(9)6(10)5(3)7(12)11-13/h1-2,13H,(H,11,12) |
InChIKey | InChI | 1.03 | YFACAFBGONHFNI-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)c1c(F)ccc(F)c1F |
SMILES | CACTVS | 3.385 | ONC(=O)c1c(F)ccc(F)c1F |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1F)C(=O)NO)F)F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1F)C(=O)NO)F)F |