SMILES:
O=C1c2ccccc2C(=O)N1CCCc1nc([N+](=O)[O-])c[nH]1Molecular Processing
Molecular formula
C14H12N4O4
Molecular weight
300.27
Exact mass
300.0859
XLogP
1.55
TPSA
109.2
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
75.37
Supplementary Information
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