SMILES:
C#C[C@@H](C)N(OC(=O)Oc1ccccc1)C(=O)Oc1ccccc1Molecular Processing
Molecular formula
C18H15NO5
Molecular weight
325.32
Exact mass
325.095
XLogP
3.64
TPSA
65.07
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
86.15
Supplementary Information
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