The Biofilms Structural Database |
TX1 homolog (compound 19) |
|
---|---|
6D6P |
|
Code
FY1 | |
Name |
N-{[3,5-dibromo-2-(methoxymethoxy)phenyl]methyl}-2-nitrobenzamide |
Molecular Weight |
474.1 |
Isomeric SMILES |
COCOc1c(Br)cc(Br)cc1CNC(=O)c1ccccc1[N+]([O-])=O |
Formula |
C16H14Br2N2O5 |
Identifiers |
~{N}-[[3,5-bis(bromanyl)-2-(methoxymethoxy)phenyl]methyl]-2-nitro-benzamide |
Formal Charge |
0 |
InChI |
InChI=1S/C16H14Br2N2O5/c1-24-9-25-15-10(6-11(17)7-13(15)18)8-19-16(21)12-4-2-3-5-14(12)20(22)23/h2-7H,8-9H2,1H3,(H,19,21) |
Atom Count |
39 |
InChIKey |
ZLGSUAWZOLKSNW-UHFFFAOYSA-N |
PDB codes |
6D6P |
Type |
Non-polymer |
Chiral Atom Count |
0 |
Chiral Atoms |
n/a |
Bond Count |
40 |
Aromatic Bond Count |
12 |
Leaving Atoms |
n/a |