SMILES:
CCOC(=O)C(=O)Nc1cc2c3c(cccc3c1[N+](=O)[O-])C(=O)OC2=OMolecular Processing
Molecular formula
C16H10N2O8
Molecular weight
358.26
Exact mass
358.0437
XLogP
1.56
TPSA
141.91
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
85.61
Supplementary Information
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