Name: N-(4-hydroxypyridin-3-yl)-4-nitrobenzamide
SMILES:
O=C(Nc1cnccc1O)c1ccc([N+](=O)[O-])cc1Molecular Processing
Molecular formula
C12H9N3O4
Molecular weight
259.22
Exact mass
259.0593
XLogP
1.95
TPSA
105.36
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
66.95
Supplementary Information
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