C=COCCc1cccc2c1C(=O)NC2=O
SMILES: C=COCCc1cccc2c1C(=O)NC2=O

Molecular Processing

Molecular formula
C12H11NO3
Molecular weight
217.22
Exact mass
217.0739
XLogP
1.27
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
58.09

Supplementary Information

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