FBW
Summary
Name: | 3-fluorobenzenesulfonamide |
Formula: | C6 H6 F N O2 S |
Formal charge: | 0 |
Formula weight: | 175.181 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 3-fluorobenzenesulfonamide |
OpenEye OEToolkits | 1.6.1 | 3-fluorobenzenesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(c1cc(F)ccc1)N |
SMILES_CANONICAL | CACTVS | 3.352 | N[S](=O)(=O)c1cccc(F)c1 |
SMILES | CACTVS | 3.352 | N[S](=O)(=O)c1cccc(F)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1cc(cc(c1)S(=O)(=O)N)F |
SMILES | OpenEye OEToolkits | 1.6.1 | c1cc(cc(c1)S(=O)(=O)N)F |
InChI | InChI | 1.03 | InChI=1S/C6H6FNO2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,(H2,8,9,10) |
InChIKey | InChI | 1.03 | CRINBBOGNYCAOV-UHFFFAOYSA-N |