CC1Cc2cc(S(N)(=O)=O)cc(C(=O)O)c2O1
SMILES: CC1Cc2cc(S(N)(=O)=O)cc(C(=O)O)c2O1

Molecular Processing

Molecular formula
C10H11NO5S
Molecular weight
257.27
Exact mass
257.0358
XLogP
0.36
TPSA
106.69
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
58.57

Supplementary Information

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