COc1cc(NC(C)=O)ccc1C(C)=O
SMILES: COc1cc(NC(C)=O)ccc1C(C)=O

Molecular Processing

Molecular formula
C11H13NO3
Molecular weight
207.23
Exact mass
207.0895
XLogP
1.86
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
57.3

Supplementary Information

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