الاسم: (R)-2-(4-nitrobenzenesulphonyloxy)-3-methoxycarbonyl-2-penten-4-olide
SMILES:
COC(=O)C1=C(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C(=O)O[C@@H]1CMolecular Processing
Molecular formula
C13H11NO9S
Molecular weight
357.3
Exact mass
357.0155
XLogP
0.67
TPSA
139.11
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
75.96
Supplementary Information
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