C[N+](C)(C)Cc1ccccc1.O=C([O-])c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]
SMILES: C[N+](C)(C)Cc1ccccc1.O=C([O-])c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

Molecular Processing

Molecular formula
C24H22ClF3N2O5
Molecular weight
510.9
Exact mass
510.1169
XLogP
5.32
TPSA
92.5
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
2
Fraction Csp3
0.208
Molar refractivity
122.13

Supplementary Information

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