CC(=O)OC12CCN(C(C)=O)C1N(C(C)=O)c1ccc(OC(=O)Oc3ccc([N+](=O)[O-])cc3)cc12
SMILES: CC(=O)OC12CCN(C(C)=O)C1N(C(C)=O)c1ccc(OC(=O)Oc3ccc([N+](=O)[O-])cc3)cc12

Molecular Processing

Molecular formula
C23H21N3O9
Molecular weight
483.43
Exact mass
483.1278
XLogP
2.88
TPSA
145.59
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
4
Heavy atoms
35
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
118.59

Supplementary Information

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