SMILES:
CCCN(C)C(=O)c1cc(C(C)=O)cc(C(=O)OCC)c1Molecular Processing
Molecular formula
C16H21NO4
Molecular weight
291.35
Exact mass
291.1471
XLogP
2.55
TPSA
63.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
79.65
Supplementary Information
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