SMILES:
CC(C)(C)OC(=O)c1ccc(-c2cncc3ccccc23)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C20H18N2O4
Molecular weight
350.37
Exact mass
350.1267
XLogP
4.77
TPSA
82.33
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
99
Supplementary Information
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