SMILES:
O=C(Cc1ccccc1)N[C@@H]1CON(C2(C(=O)OCc3ccccc3)C=CC(=O)O2)C1=OMolecular Processing
Molecular formula
C23H20N2O7
Molecular weight
436.42
Exact mass
436.1271
XLogP
1.04
TPSA
111.24
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
109.08
Supplementary Information
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