SMILES:
CCOC(=O)N(C)C1CCC=C(C#Cc2ccccc2)C1Molecular Processing
Molecular formula
C18H21NO2
Molecular weight
283.37
Exact mass
283.1572
XLogP
3.61
TPSA
29.54
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
83.83
Supplementary Information
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