SMILES:
O=C(NC12CC3CC(C1)C(=O)C(C3)C2)OCc1ccccc1Molecular Processing
Molecular formula
C18H21NO3
Molecular weight
299.37
Exact mass
299.1521
XLogP
3.06
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
81.06
Supplementary Information
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