COC(=O)c1ccc(S(C)(=O)=O)cc1N(S(C)(=O)=O)S(C)(=O)=O
Name: methyl 2-[N,N-bis(methylsulphonyl)amino]-4-methylsulphonylbenzoate
SMILES: COC(=O)c1ccc(S(C)(=O)=O)cc1N(S(C)(=O)=O)S(C)(=O)=O

Molecular Processing

Molecular formula
C11H15NO8S3
Molecular weight
385.44
Exact mass
384.996
XLogP
-0.4
TPSA
131.96
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
83.06

Supplementary Information

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