SMILES:
CCOC(=O)C1=C(C)N2CCCC2=C(C(C)=O)C1c1cccc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C20H22N2O5
Molecular weight
370.41
Exact mass
370.1529
XLogP
3.47
TPSA
89.75
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
98.82
Supplementary Information
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