SMILES:
COC(=O)CC12CC3CC(C1)CC(c1ccc([N+](=O)[O-])cc1)(C3)C2Molecular Processing
Molecular formula
C19H23NO4
Molecular weight
329.4
Exact mass
329.1627
XLogP
4
TPSA
69.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
24
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
88.52
Supplementary Information
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