SMILES:
CNc1ccc(Oc2ccncc2C(=O)OC)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C14H13N3O5
Molecular weight
303.27
Exact mass
303.0855
XLogP
2.61
TPSA
103.59
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
78.29
Supplementary Information
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