SMILES:
CCOC(=O)c1oc2cccc(C#CCN(C)C)c2c1CMolecular Processing
Molecular formula
C17H19NO3
Molecular weight
285.34
Exact mass
285.1365
XLogP
2.83
TPSA
42.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
82.34
Supplementary Information
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