이름: N-[4-[(4-formylphenyl)oxy]-2-nitro-6-(trifluoromethyl)phenyl]acetamide
SMILES:
CC(=O)Nc1c([N+](=O)[O-])cc(Oc2ccc(C=O)cc2)cc1C(F)(F)FMolecular Processing
Molecular formula
C16H11F3N2O5
Molecular weight
368.27
Exact mass
368.062
XLogP
4.18
TPSA
98.54
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
84.31
Supplementary Information
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