SMILES:
COc1cc2c(cc1OC)CC[N+](Cc1ccc(Cl)cc1)=C2.[Cl-]Molecular Processing
Molecular formula
C18H19Cl2NO2
Molecular weight
352.26
Exact mass
351.0793
XLogP
0.55
TPSA
21.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.278
Molar refractivity
88.7
Supplementary Information
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