CCOC(=O)c1ccc(F)c(Cl)c1N(CC)S(C)(=O)=O
Name: ethyl 3-chloro-2-(N-ethyl-N-methylsulphonylamino)-4-fluorobenzoate
SMILES: CCOC(=O)c1ccc(F)c(Cl)c1N(CC)S(C)(=O)=O

Molecular Processing

Molecular formula
C12H15ClFNO4S
Molecular weight
323.77
Exact mass
323.0394
XLogP
2.44
TPSA
63.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
75.23

Supplementary Information

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