L1Q
Summary
Name: | 2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide |
Formula: | C9 H9 F4 N O2 S |
Formal charge: | 0 |
Formula weight: | 271.232 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H9F4NO2S/c1-2-3-4-5(10)7(12)9(17(14,15)16)8(13)6(4)11/h2-3H2,1H3,(H2,14,15,16) |
InChIKey | InChI | 1.03 | QCRSPYSAXKPYLP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O |
SMILES | CACTVS | 3.385 | CCCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCc1c(c(c(c(c1F)F)S(=O)(=O)N)F)F |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCc1c(c(c(c(c1F)F)S(=O)(=O)N)F)F |