O=[N+]([O-])c1ccc(OC2CCN(Cc3ccccc3)C2)cc1
SMILES: O=[N+]([O-])c1ccc(OC2CCN(Cc3ccccc3)C2)cc1

Molecular Processing

Molecular formula
C17H18N2O3
Molecular weight
298.34
Exact mass
298.1317
XLogP
3.25
TPSA
55.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
83.85

Supplementary Information

Details werden geladen…

An 4 Reaktionen beteiligt