CCOC(=O)c1ccc(S(C)(=O)=O)cc1N(CC)S(C)(=O)=O
Name: ethyl 2-(N-ethyl-N-methylsulphonylamino)-4-methylsulphonylbenzoate
SMILES: CCOC(=O)c1ccc(S(C)(=O)=O)cc1N(CC)S(C)(=O)=O

Molecular Processing

Molecular formula
C13H19NO6S2
Molecular weight
349.43
Exact mass
349.0654
XLogP
1.05
TPSA
97.82
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
83.37

Supplementary Information

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