CN(C(=O)OC(C)(C)C)c1ccc(Br)c([N+](=O)[O-])n1
SMILES: CN(C(=O)OC(C)(C)C)c1ccc(Br)c([N+](=O)[O-])n1

Molecular Processing

Molecular formula
C11H14BrN3O4
Molecular weight
332.15
Exact mass
331.0168
XLogP
3.12
TPSA
85.57
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
73.23

Supplementary Information

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