SMILES:
O=C(Nc1ccc(N2CCOCC2)cc1)Oc1ccc([N+](=O)[O-])cc1Molecular Processing
Molecular formula
C17H17N3O5
Molecular weight
343.34
Exact mass
343.1168
XLogP
3.04
TPSA
93.94
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
92.22
Supplementary Information
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