SMILES:
COc1cc(N2CCC(N(C)C)CC2)ccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C14H21N3O3
Molecular weight
279.34
Exact mass
279.1583
XLogP
2.13
TPSA
58.85
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
78.57
Supplementary Information
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