CCCCCC(CCCN(CCCCCCC(=O)OCC)S(C)(=O)=O)OC(C)=O
Name: ethyl 7-[N-(4-acetoxynonyl)methanesulfonamido]heptanoate
SMILES: CCCCCC(CCCN(CCCCCCC(=O)OCC)S(C)(=O)=O)OC(C)=O

Molecular Processing

Molecular formula
C21H41NO6S
Molecular weight
435.63
Exact mass
435.2655
XLogP
4.05
TPSA
89.98
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
18
Heavy atoms
29
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.905
Molar refractivity
115.06

Supplementary Information

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