SMILES:
CCOC(=O)C(=O)c1cc(N)c(C2CCCCC2)c(Cl)c1Molecular Processing
Molecular formula
C16H20ClNO3
Molecular weight
309.79
Exact mass
309.1132
XLogP
3.72
TPSA
69.39
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
82.65
Supplementary Information
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