ZA5
Summary
Name: | [(2,6-DIFLUOROPHENYL)CARBONYLAMINO]METHYL-TRIHYDROXY-BORON |
Formula: | C8 H9 B F2 N O4 |
Formal charge: | -1 |
Formula weight: | 231.969 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.6.1 | [(2,6-difluorophenyl)carbonylamino]methyl-trihydroxy-boron |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | O[B-](O)(O)CNC(=O)c1c(F)cccc1F |
SMILES | CACTVS | 3.352 | O[B-](O)(O)CNC(=O)c1c(F)cccc1F |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | [B-](CNC(=O)c1c(cccc1F)F)(O)(O)O |
SMILES | OpenEye OEToolkits | 1.6.1 | [B-](CNC(=O)c1c(cccc1F)F)(O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C8H9BF2NO4/c10-5-2-1-3-6(11)7(5)8(13)12-4-9(14,15)16/h1-3,14-16H,4H2,(H,12,13)/q-1 |
InChIKey | InChI | 1.03 | WTOJBPXTZMRWEB-UHFFFAOYSA-N |