SMILES:
COC(=C1C(=O)N(C(C)=O)c2cc(Cl)ccc21)c1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C19H14ClNO5
Molecular weight
371.78
Exact mass
371.0561
XLogP
3.48
TPSA
65.07
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
96.01
Supplementary Information
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