SMILES:
CC(C)(C)OC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1Molecular Processing
Molecular formula
C16H22N2O5
Molecular weight
322.36
Exact mass
322.1529
XLogP
3.37
TPSA
81.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
84.55
Supplementary Information
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