O=C(c1ccc(Cl)cc1)c1cc(Br)c2[nH]c(=O)cc(O)c2c1
SMILES: O=C(c1ccc(Cl)cc1)c1cc(Br)c2[nH]c(=O)cc(O)c2c1

Molecular Processing

Molecular formula
C16H9BrClNO3
Molecular weight
378.61
Exact mass
376.9454
XLogP
3.88
TPSA
70.16
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
88.82

Supplementary Information

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