The Biofilms Structural Database
|
|
The Biofilms Structural Database |
BDM44847 |
|
|---|---|
6HOC |
|
Code
GJE | |
|
Name |
4-azido-~{N}-[3,3,3-tris(fluoranyl)propyl]benzamide |
|
Molecular Weight |
258.2 |
|
Isomeric SMILES |
c1cc(ccc1C(=O)NCCC(F)(F)F)N=[N+]=[N-] |
|
Formula |
C10H9F3N4O |
|
Identifiers |
4-azido-~{N}-[3,3,3-tris(fluoranyl)propyl]benzamide |
|
Formal Charge |
0 |
|
InChI |
InChI=1S/C10H9F3N4O/c11-10(12,13)5-6-15-9(18)7-1-3-8(4-2-7)16-17-14/h1-4H,5-6H2,(H,15,18) |
|
Atom Count |
27 |
|
InChIKey |
PCHDVKCHSJFSLZ-UHFFFAOYSA-N |
|
PDB codes |
6HOC |
|
Type |
NON-POLYMER |
|
Chiral Atom Count |
0 |
|
Chiral Atoms |
n/a |
|
Bond Count |
27 |
|
Aromatic Bond Count |
6 |
|
Leaving Atoms |
n/a |