SMILES:
CC(C)=CCOc1cc(-c2coc(C)c2C(N)=O)ccc1ClMolecular Processing
Molecular formula
C17H18ClNO3
Molecular weight
319.79
Exact mass
319.0975
XLogP
4.35
TPSA
65.46
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
87.33
Supplementary Information
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