SMILES:
COC(=O)c1cccc2c(C(=O)C3C(C)(C)C3(C)C)c[nH]c12Molecular Processing
Molecular formula
C18H21NO3
Molecular weight
299.37
Exact mass
299.1521
XLogP
3.82
TPSA
59.16
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
85.02
Supplementary Information
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