CCOC(=O)C1=C(C)NC(CC)=C(C(=O)OCC)C1c1cc([N+](=O)[O-])ccc1OCCCCNCC(O)COc1ccccc1
SMILES: CCOC(=O)C1=C(C)NC(CC)=C(C(=O)OCC)C1c1cc([N+](=O)[O-])ccc1OCCCCNCC(O)COc1ccccc1

Molecular Processing

Molecular formula
C33H43N3O9
Molecular weight
625.72
Exact mass
625.2999
XLogP
4.53
TPSA
158.49
H-bond donors
3
H-bond acceptors
11
Rotatable bonds
18
Heavy atoms
45
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
167.8

Supplementary Information

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