SMILES:
CCOC(=O)C=CC#CC(C)c1ccccc1C(=O)c1ocnc1CMolecular Processing
Molecular formula
C20H19NO4
Molecular weight
337.38
Exact mass
337.1314
XLogP
3.44
TPSA
69.4
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
93.08
Supplementary Information
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