The Biofilms Structural Database
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
Chiral Atoms
n/a
Bond Count
40
Aromatic Bond Count
12
Leaving Atoms