SMILES:
CC(=O)OC[C@H](c1ccccc1)N1C(=O)C=CC1=OMolecular Processing
Molecular formula
C14H13NO4
Molecular weight
259.26
Exact mass
259.0845
XLogP
1.22
TPSA
63.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
66.81
Supplementary Information
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