CCOC(=O)C1CCC(OS(C)(=O)=O)C(NC(=O)OC(C)(C)C)C1
Name: ethyl 3-(tert-butoxycarbonylamino)-4-(methylsulfonyloxy)cyclohexanecarboxylate
SMILES: CCOC(=O)C1CCC(OS(C)(=O)=O)C(NC(=O)OC(C)(C)C)C1

Molecular Processing

Molecular formula
C15H27NO7S
Molecular weight
365.45
Exact mass
365.1508
XLogP
1.59
TPSA
108
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
24
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.867
Molar refractivity
86.85

Supplementary Information

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