O=[N+]([O-])c1ccc2c(c1)OC(CO)CO2
SMILES: O=[N+]([O-])c1ccc2c(c1)OC(CO)CO2

Molecular Processing

Molecular formula
C9H9NO5
Molecular weight
211.17
Exact mass
211.0481
XLogP
0.73
TPSA
81.83
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
50.09

Supplementary Information

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